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"JU.M4",["JU.T3"],function(){c$=t(function(){this.m33=this.m32=this.m31=this.m30=this.m23=this.m13=this.m03=0;p(this,arguments)},JU,"M4",JU.M34);c$.newA16=c(c$,"newA16",function(a){var b=new JU.M4;b.m00=a[0];b.m01=a[1];b.m02=a[2];b.m03=a[3];b.m10=a[4];b.m11=a[5];b.m12=a[6];b.m13=a[7];b.m20=a[8];b.m21=a[9];b.m22=a[10];b.m23=a[11];b.m30=a[12];b.m31=a[13];b.m32=a[14];b.m33=a[15];return b},"~A");c$.newM4=c(c$,"newM4",function(a){var b=new JU.M4;if(null==a)return b.setIdentity(),b;b.setToM3(a);b.m03=a.m03;
b.m13=a.m13;b.m23=a.m23;b.m30=a.m30;b.m31=a.m31;b.m32=a.m32;b.m33=a.m33;return b},"JU.M4");c$.newMV=c(c$,"newMV",function(a,b){var d=new JU.M4;d.setMV(a,b);return d},"JU.M3,JU.T3");c(c$,"setZero",function(){this.clear33();this.m03=this.m13=this.m23=this.m30=this.m31=this.m32=this.m33=0});c(c$,"setIdentity",function(){this.setZero();this.m00=this.m11=this.m22=this.m33=1});c(c$,"setM4",function(a){this.setM33(a);this.m03=a.m03;this.m13=a.m13;this.m23=a.m23;this.m30=a.m30;this.m31=a.m31;this.m32=a.m32;
this.m33=a.m33;return this},"JU.M4");c(c$,"setMV",function(a,b){this.setM33(a);this.setTranslation(b);this.m33=1},"JU.M3,JU.T3");c(c$,"setToM3",function(a){this.setM33(a);this.m03=this.m13=this.m23=this.m30=this.m31=this.m32=0;this.m33=1},"JU.M34");c(c$,"setToAA",function(a){this.setIdentity();this.setAA33(a)},"JU.A4");c(c$,"setA",function(a){this.m00=a[0];this.m01=a[1];this.m02=a[2];this.m03=a[3];this.m10=a[4];this.m11=a[5];this.m12=a[6];this.m13=a[7];this.m20=a[8];this.m21=a[9];this.m22=a[10];this.m23=
a[11];this.m30=a[12];this.m31=a[13];this.m32=a[14];this.m33=a[15]},"~A");c(c$,"setTranslation",function(a){this.m03=a.x;this.m13=a.y;this.m23=a.z},"JU.T3");c(c$,"setElement",function(a,b,d){if(3>a&&3>b)this.set33(a,b,d);else{(3<a||3<b)&&this.err();switch(a){case 0:this.m03=d;return;case 1:this.m13=d;return;case 2:this.m23=d;return}switch(b){case 0:this.m30=d;break;case 1:this.m31=d;break;case 2:this.m32=d;break;case 3:this.m33=d}}},"~N,~N,~N");c(c$,"getElement",function(a,b){if(3>a&&3>b)return this.get33(a,
b);if(3<a||3<b)return this.err(),0;switch(a){case 0:return this.m03;case 1:return this.m13;case 2:return this.m23;default:switch(b){case 0:return this.m30;case 1:return this.m31;case 2:return this.m32;default:return this.m33}}},"~N,~N");c(c$,"getTranslation",function(a){a.x=this.m03;a.y=this.m13;a.z=this.m23},"JU.T3");c(c$,"getRotationScale",function(a){a.m00=this.m00;a.m01=this.m01;a.m02=this.m02;a.m10=this.m10;a.m11=this.m11;a.m12=this.m12;a.m20=this.m20;a.m21=this.m21;a.m22=this.m22},"JU.M3");
c(c$,"setRotationScale",function(a){this.m00=a.m00;this.m01=a.m01;this.m02=a.m02;this.m10=a.m10;this.m11=a.m11;this.m12=a.m12;this.m20=a.m20;this.m21=a.m21;this.m22=a.m22},"JU.M3");c(c$,"setRowA",function(a,b){3>a&&this.setRow33(a,b);switch(a){case 0:this.m03=b[3];return;case 1:this.m13=b[3];return;case 2:this.m23=b[3];return;case 3:this.m30=b[0];this.m31=b[1];this.m32=b[2];this.m33=b[3];return}this.err()},"~N,~A");j(c$,"getRow",function(a,b){3>a&&this.getRow33(a,b);switch(a){case 0:b[3]=this.m03;
return;case 1:b[3]=this.m13;return;case 2:b[3]=this.m23;return;case 3:b[0]=this.m30;b[1]=this.m31;b[2]=this.m32;b[3]=this.m33;return}this.err()},"~N,~A");c(c$,"setColumn4",function(a,b,d,g,c){0==a?(this.m00=b,this.m10=d,this.m20=g,this.m30=c):1==a?(this.m01=b,this.m11=d,this.m21=g,this.m31=c):2==a?(this.m02=b,this.m12=d,this.m22=g,this.m32=c):3==a?(this.m03=b,this.m13=d,this.m23=g,this.m33=c):this.err()},"~N,~N,~N,~N,~N");c(c$,"setColumnA",function(a,b){3>a&&this.setColumn33(a,b);switch(a){case 0:this.m30=
b[3];break;case 1:this.m31=b[3];break;case 2:this.m32=b[3];break;case 3:this.m03=b[0];this.m13=b[1];this.m23=b[2];this.m33=b[3];break;default:this.err()}},"~N,~A");c(c$,"getColumn",function(a,b){3>a&&this.getColumn33(a,b);switch(a){case 0:b[3]=this.m30;break;case 1:b[3]=this.m31;break;case 2:b[3]=this.m32;break;case 3:b[0]=this.m03;b[1]=this.m13;b[2]=this.m23;b[3]=this.m33;break;default:this.err()}},"~N,~A");c(c$,"sub",function(a){this.sub33(a);this.m03-=a.m03;this.m13-=a.m13;this.m23-=a.m23;this.m30-=
a.m30;this.m31-=a.m31;this.m32-=a.m32;this.m33-=a.m33},"JU.M4");c(c$,"add",function(a){this.m03+=a.x;this.m13+=a.y;this.m23+=a.z},"JU.T3");c(c$,"transpose",function(){this.transpose33();var a=this.m03;this.m03=this.m30;this.m30=a;a=this.m13;this.m13=this.m31;this.m31=a;a=this.m23;this.m23=this.m32;this.m32=a});c(c$,"invert",function(){var a=this.determinant4();if(0==a)return this;a=1/a;this.set(this.m11*(this.m22*this.m33-this.m23*this.m32)+this.m12*(this.m23*this.m31-this.m21*this.m33)+this.m13*
(this.m21*this.m32-this.m22*this.m31),this.m21*(this.m02*this.m33-this.m03*this.m32)+this.m22*(this.m03*this.m31-this.m01*this.m33)+this.m23*(this.m01*this.m32-this.m02*this.m31),this.m31*(this.m02*this.m13-this.m03*this.m12)+this.m32*(this.m03*this.m11-this.m01*this.m13)+this.m33*(this.m01*this.m12-this.m02*this.m11),this.m01*(this.m13*this.m22-this.m12*this.m23)+this.m02*(this.m11*this.m23-this.m13*this.m21)+this.m03*(this.m12*this.m21-this.m11*this.m22),this.m12*(this.m20*this.m33-this.m23*this.m30)+
this.m13*(this.m22*this.m30-this.m20*this.m32)+this.m10*(this.m23*this.m32-this.m22*this.m33),this.m22*(this.m00*this.m33-this.m03*this.m30)+this.m23*(this.m02*this.m30-this.m00*this.m32)+this.m20*(this.m03*this.m32-this.m02*this.m33),this.m32*(this.m00*this.m13-this.m03*this.m10)+this.m33*(this.m02*this.m10-this.m00*this.m12)+this.m30*(this.m03*this.m12-this.m02*this.m13),this.m02*(this.m13*this.m20-this.m10*this.m23)+this.m03*(this.m10*this.m22-this.m12*this.m20)+this.m00*(this.m12*this.m23-this.m13*
this.m22),this.m13*(this.m20*this.m31-this.m21*this.m30)+this.m10*(this.m21*this.m33-this.m23*this.m31)+this.m11*(this.m23*this.m30-this.m20*this.m33),this.m23*(this.m00*this.m31-this.m01*this.m30)+this.m20*(this.m01*this.m33-this.m03*this.m31)+this.m21*(this.m03*this.m30-this.m00*this.m33),this.m33*(this.m00*this.m11-this.m01*this.m10)+this.m30*(this.m01*this.m13-this.m03*this.m11)+this.m31*(this.m03*this.m10-this.m00*this.m13),this.m03*(this.m11*this.m20-this.m10*this.m21)+this.m00*(this.m13*this.m21-
this.m11*this.m23)+this.m01*(this.m10*this.m23-this.m13*this.m20),this.m10*(this.m22*this.m31-this.m21*this.m32)+this.m11*(this.m20*this.m32-this.m22*this.m30)+this.m12*(this.m21*this.m30-this.m20*this.m31),this.m20*(this.m02*this.m31-this.m01*this.m32)+this.m21*(this.m00*this.m32-this.m02*this.m30)+this.m22*(this.m01*this.m30-this.m00*this.m31),this.m30*(this.m02*this.m11-this.m01*this.m12)+this.m31*(this.m00*this.m12-this.m02*this.m10)+this.m32*(this.m01*this.m10-this.m00*this.m11),this.m00*(this.m11*
this.m22-this.m12*this.m21)+this.m01*(this.m12*this.m20-this.m10*this.m22)+this.m02*(this.m10*this.m21-this.m11*this.m20));this.scale(a);return this});c(c$,"set",function(a,b,d,g,c,e,h,k,l,j,m,r,x,y,F,C){this.m00=a;this.m01=b;this.m02=d;this.m03=g;this.m10=c;this.m11=e;this.m12=h;this.m13=k;this.m20=l;this.m21=j;this.m22=m;this.m23=r;this.m30=x;this.m31=y;this.m32=F;this.m33=C},"~N,~N,~N,~N,~N,~N,~N,~N,~N,~N,~N,~N,~N,~N,~N,~N");c(c$,"determinant4",function(){return(this.m00*this.m11-this.m01*this.m10)*
(this.m22*this.m33-this.m23*this.m32)-(this.m00*this.m12-this.m02*this.m10)*(this.m21*this.m33-this.m23*this.m31)+(this.m00*this.m13-this.m03*this.m10)*(this.m21*this.m32-this.m22*this.m31)+(this.m01*this.m12-this.m02*this.m11)*(this.m20*this.m33-this.m23*this.m30)-(this.m01*this.m13-this.m03*this.m11)*(this.m20*this.m32-this.m22*this.m30)+(this.m02*this.m13-this.m03*this.m12)*(this.m20*this.m31-this.m21*this.m30)});c(c$,"scale",function(a){this.mul33(a);this.m03*=a;this.m13*=a;this.m23*=a;this.m30*=
a;this.m31*=a;this.m32*=a;this.m33*=a},"~N");c(c$,"mul",function(a){this.mul2(this,a)},"JU.M4");c(c$,"mul2",function(a,b){this.set(a.m00*b.m00+a.m01*b.m10+a.m02*b.m20+a.m03*b.m30,a.m00*b.m01+a.m01*b.m11+a.m02*b.m21+a.m03*b.m31,a.m00*b.m02+a.m01*b.m12+a.m02*b.m22+a.m03*b.m32,a.m00*b.m03+a.m01*b.m13+a.m02*b.m23+a.m03*b.m33,a.m10*b.m00+a.m11*b.m10+a.m12*b.m20+a.m13*b.m30,a.m10*b.m01+a.m11*b.m11+a.m12*b.m21+a.m13*b.m31,a.m10*b.m02+a.m11*b.m12+a.m12*b.m22+a.m13*b.m32,a.m10*b.m03+a.m11*b.m13+a.m12*b.m23+
a.m13*b.m33,a.m20*b.m00+a.m21*b.m10+a.m22*b.m20+a.m23*b.m30,a.m20*b.m01+a.m21*b.m11+a.m22*b.m21+a.m23*b.m31,a.m20*b.m02+a.m21*b.m12+a.m22*b.m22+a.m23*b.m32,a.m20*b.m03+a.m21*b.m13+a.m22*b.m23+a.m23*b.m33,a.m30*b.m00+a.m31*b.m10+a.m32*b.m20+a.m33*b.m30,a.m30*b.m01+a.m31*b.m11+a.m32*b.m21+a.m33*b.m31,a.m30*b.m02+a.m31*b.m12+a.m32*b.m22+a.m33*b.m32,a.m30*b.m03+a.m31*b.m13+a.m32*b.m23+a.m33*b.m33)},"JU.M4,JU.M4");c(c$,"transform",function(a){this.transform2(a,a)},"JU.T4");c(c$,"transform2",function(a,
b){b.set4(this.m00*a.x+this.m01*a.y+this.m02*a.z+this.m03*a.w,this.m10*a.x+this.m11*a.y+this.m12*a.z+this.m13*a.w,this.m20*a.x+this.m21*a.y+this.m22*a.z+this.m23*a.w,this.m30*a.x+this.m31*a.y+this.m32*a.z+this.m33*a.w)},"JU.T4,JU.T4");c(c$,"rotTrans",function(a){this.rotTrans2(a,a)},"JU.T3");c(c$,"rotTrans2",function(a,b){b.set(this.m00*a.x+this.m01*a.y+this.m02*a.z+this.m03,this.m10*a.x+this.m11*a.y+this.m12*a.z+this.m13,this.m20*a.x+this.m21*a.y+this.m22*a.z+this.m23);return b},"JU.T3,JU.T3");c(c$,
"setAsXYRotation",function(a){this.setIdentity();var b=Math.cos(a);a=Math.sin(a);this.m22=b;this.m23=-a;this.m32=a;this.m33=b;return this},"~N");c(c$,"setAsYZRotation",function(a){this.setIdentity();var b=Math.cos(a);a=Math.sin(a);this.m00=b;this.m03=-a;this.m30=a;this.m33=b;return this},"~N");c(c$,"setAsXZRotation",function(a){this.setIdentity();var b=Math.cos(a);a=Math.sin(a);this.m11=b;this.m13=-a;this.m31=a;this.m33=b;return this},"~N");j(c$,"equals",function(a){return!n(a,JU.M4)?!1:this.m00==
a.m00&&this.m01==a.m01&&this.m02==a.m02&&this.m03==a.m03&&this.m10==a.m10&&this.m11==a.m11&&this.m12==a.m12&&this.m13==a.m13&&this.m20==a.m20&&this.m21==a.m21&&this.m22==a.m22&&this.m23==a.m23&&this.m30==a.m30&&this.m31==a.m31&&this.m32==a.m32&&this.m33==a.m33},"~O");j(c$,"hashCode",function(){return JU.T3.floatToIntBits(this.m00)^JU.T3.floatToIntBits(this.m01)^JU.T3.floatToIntBits(this.m02)^JU.T3.floatToIntBits(this.m03)^JU.T3.floatToIntBits(this.m10)^JU.T3.floatToIntBits(this.m11)^JU.T3.floatToIntBits(this.m12)^
JU.T3.floatToIntBits(this.m13)^JU.T3.floatToIntBits(this.m20)^JU.T3.floatToIntBits(this.m21)^JU.T3.floatToIntBits(this.m22)^JU.T3.floatToIntBits(this.m23)^JU.T3.floatToIntBits(this.m30)^JU.T3.floatToIntBits(this.m31)^JU.T3.floatToIntBits(this.m32)^JU.T3.floatToIntBits(this.m33)});j(c$,"toString",function(){return"[\n  ["+this.m00+"\t"+this.m01+"\t"+this.m02+"\t"+this.m03+"]\n  ["+this.m10+"\t"+this.m11+"\t"+this.m12+"\t"+this.m13+"]\n  ["+this.m20+"\t"+this.m21+"\t"+this.m22+"\t"+this.m23+"]\n  ["+
this.m30+"\t"+this.m31+"\t"+this.m32+"\t"+this.m33+"] ]"});c(c$,"round",function(a){this.m00=this.rnd(this.m00,a);this.m01=this.rnd(this.m01,a);this.m02=this.rnd(this.m02,a);this.m03=this.rnd(this.m03,a);this.m10=this.rnd(this.m10,a);this.m11=this.rnd(this.m11,a);this.m12=this.rnd(this.m12,a);this.m13=this.rnd(this.m13,a);this.m20=this.rnd(this.m20,a);this.m21=this.rnd(this.m21,a);this.m22=this.rnd(this.m22,a);this.m23=this.rnd(this.m23,a);this.m30=this.rnd(this.m30,a);this.m31=this.rnd(this.m31,
a);this.m32=this.rnd(this.m32,a);this.m33=this.rnd(this.m33,a);return this},"~N");c(c$,"rnd",function(a,b){return Math.abs(a)<b?0:a},"~N,~N")});s("JU");v(["java.io.OutputStream","javajs.api.GenericOutputChannel"],"JU.OC","java.io.BufferedWriter $.ByteArrayOutputStream $.OutputStreamWriter java.lang.Float JU.Base64 $.SB".split(" "),function(){c$=t(function(){this.bw=this.fileName=this.bytePoster=null;this.isLocalFile=!1;this.byteCount=0;this.closed=this.isCanceled=!1;this.type=this.sb=this.os=null;
this.$isBase64=!1;this.bytes=this.os0=null;this.bigEndian=!0;p(this,arguments)},JU,"OC",java.io.OutputStream,javajs.api.GenericOutputChannel);q(c$,function(){I(this,JU.OC,[])});q(c$,function(a){I(this,JU.OC,[]);this.setParams(null,a,!1,null)},"~S");c(c$,"setParams",function(a,b,d,g){this.bytePoster=a;if(this.$isBase64=";base64,".equals(b))b=null,this.os0=g,g=null;this.fileName=b;this.os=g;this.isLocalFile=null!=b&&!JU.OC.isRemote(b);d&&(!this.$isBase64&&null!=g)&&(this.bw=new java.io.BufferedWriter(new java.io.OutputStreamWriter(g)));
return this},"javajs.api.BytePoster,~S,~B,java.io.OutputStream");j(c$,"isBigEndian",function(){return this.bigEndian});c(c$,"setBigEndian",function(a){this.bigEndian=a},"~B");c(c$,"setBytes",function(a){this.bytes=a;return this},"~A");c(c$,"getFileName",function(){return this.fileName});c(c$,"getName",function(){return null==this.fileName?null:this.fileName.substring(this.fileName.lastIndexOf("/")+1)});c(c$,"getByteCount",function(){return this.byteCount});c(c$,"setType",function(a){this.type=a},
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l=this.asc.ac;k<l;k++)d[k].partialCharge=0;for(var j=0,k=A(e[j++]);0<=--k;){var m=A(e[j++])+this.iatom0-1,r=e[j++];d[m].partialCharge=r;h++}}catch(x){k=this.asc.getLastAtomSetAtomIndex();for(l=this.asc.ac;k<l;k++)d[k].partialCharge=0;JU.Logger.error("error reading "+g+" field -- partial charges cleared")}JU.Logger.info(h+" partial charges read")}else if(g.toUpperCase().contains("ATOM_NAMES")){h=0;try{for(var y=JU.PT.getTokens(c),j=0,k=this.parseIntStr(y[j++]);0<=--k;){for(var F;-2147483648==(F=this.parseIntStr(y[j++])););
var m=F+this.iatom0-1,C=y[j++];C.equals(".")||(d[m].atomName=C);h++}}catch(n){JU.Logger.error("error reading "+g+" field")}JU.Logger.info(h+" atom names read")}},"java.util.Map,JU.Lst");c(c$,"addMolAtom",function(a,b,d,g,c,e,h){switch(b){case 0:break;case 1:d="1H";break;case 2:d="2H";break;case 3:d="3H";break;default:d=b+d}this.optimize2D&&0!=h&&(this.optimize2D=!1);b=new J.adapter.smarter.Atom;b.elementSymbol=d;b.formalCharge=g;this.setAtomCoordXYZ(b,c,e,h);-2147483648==a?this.asc.addAtom(b):(this.haveAtomSerials=
!0,b.atomSerial=a,this.asc.addAtomWithMappedSerialNumber(b))},"~N,~N,~S,~N,~N,~N,~N");c(c$,"fixOrder",function(a,b){switch(a){default:case 0:case -10:return 1;case 1:switch(b){case 1:return 1025;case 3:case 6:return 1041}break;case 2:case 3:break;case 4:return 515;case 5:return 66;case 6:return 513;case 7:return 514;case 8:case 9:return 33;case 14:return 4;case 15:return 5;case 16:return 6}return a},"~N,~N");c(c$,"addMolBond",function(a,b,d,g){d=this.fixOrder(d,g);this.haveAtomSerials?this.asc.addNewBondFromNames(a,
b,d):this.asc.addNewBondWithOrder(this.iatom0+this.parseIntStr(a)-1,this.iatom0+this.parseIntStr(b)-1,d)},"~S,~S,~N,~N")});s("J.adapter.readers.molxyz");v(["J.adapter.smarter.AtomSetCollectionReader"],"J.adapter.readers.molxyz.XyzReader",["java.lang.Float","JU.Logger"],function(){c$=D(J.adapter.readers.molxyz,"XyzReader",J.adapter.smarter.AtomSetCollectionReader);j(c$,"checkLine",function(){var a=this.parseIntStr(this.line);if(-2147483648==a)return this.continuing=!1;this.vibrationNumber=++this.modelNumber;
if(0>=this.desiredVibrationNumber?this.doGetModel(this.modelNumber,null):this.doGetVibration(this.vibrationNumber)){this.rd();this.checkCurrentLineForScript();this.asc.newAtomSet();var b=this.line.trim();this.readAtoms(a);this.applySymmetryAndSetTrajectory();this.asc.setAtomSetName(b);if(this.isLastModel(this.modelNumber))return this.continuing=!1}else this.skipAtomSet(a);this.discardLinesUntilNonBlank();return!1});j(c$,"finalizeSubclassReader",function(){this.isTrajectory=!1;this.finalizeReaderASCR()});
c(c$,"skipAtomSet",function(a){for(this.rd();0<=--a;)this.rd()},"~N");c(c$,"readAtoms",function(a){for(var b=0;b<a;++b){this.rd();var d=this.getTokens();if(4>d.length)JU.Logger.warn("line cannot be read for XYZ atom data: "+this.line);else{var g=this.addAtomXYZSymName(d,1,null,null);this.setElementAndIsotope(g,d[0]);var c=4;switch(d.length){case 4:continue;case 5:case 6:case 8:case 9:if(0<=d[4].indexOf("."))g.partialCharge=this.parseFloatStr(d[4]);else{var e=this.parseIntStr(d[4]);-2147483648!=e&&
(g.formalCharge=e)}switch(d.length){case 5:continue;case 6:g.radius=this.parseFloatStr(d[5]);continue;case 9:g.atomSerial=this.parseIntStr(d[8])}c++;default:var e=this.parseFloatStr(d[c++]),h=this.parseFloatStr(d[c++]),d=this.parseFloatStr(d[c++]);if(Float.isNaN(e)||Float.isNaN(h)||Float.isNaN(d))continue;this.asc.addVibrationVector(g.index,e,h,d)}}}},"~N")});s("J.adapter.smarter");v(["JU.P3"],"J.adapter.smarter.Atom",["JU.AU","$.Lst","$.V3","JU.Vibration"],function(){c$=t(function(){this.index=this.atomSetIndex=
0;this.bsSymmetry=null;this.atomSite=0;this.elementSymbol=null;this.elementNumber=-1;this.atomName=null;this.formalCharge=-2147483648;this.partialCharge=NaN;this.vib=null;this.bfactor=NaN;this.foccupancy=1;this.radius=NaN;this.isHetero=!1;this.atomSerial=-2147483648;this.chainID=0;this.bondRadius=NaN;this.altLoc="\x00";this.group3=null;this.sequenceNumber=-2147483648;this.insertionCode="\x00";this.tensors=this.anisoBorU=null;this.ignoreSymmetry=!1;this.typeSymbol=null;p(this,arguments)},J.adapter.smarter,
"Atom",JU.P3,Cloneable);c(c$,"addTensor",function(a,b,d){if(null==a)return null;if(d||null==this.tensors)this.tensors=new JU.Lst;this.tensors.addLast(a);null!=b&&a.setType(b);return a},"JU.Tensor,~S,~B");q(c$,function(){I(this,J.adapter.smarter.Atom,[]);this.set(NaN,NaN,NaN)});c(c$,"getClone",function(){var a;try{a=this.clone()}catch(b){if(H(b,CloneNotSupportedException))return null;throw b;}null!=this.vib&&(a.vib=n(this.vib,JU.Vibration)?this.vib.clone():JU.V3.newV(a.vib));null!=this.anisoBorU&&
(a.anisoBorU=JU.AU.arrayCopyF(this.anisoBorU,-1));if(null!=this.tensors){a.tensors=new JU.Lst;for(var d=this.tensors.size();0<=--d;)a.tensors.addLast(this.tensors.get(d).copyTensor())}return a});c(c$,"getElementSymbol",function(){if(null==this.elementSymbol&&null!=this.atomName){for(var a=this.atomName.length,b=0,d=String.fromCharCode(0);b<a&&!J.adapter.smarter.Atom.isValidSymChar1(d=this.atomName.charAt(b));)++b;switch(a-b){case 0:break;default:if(a=this.atomName.charAt(b+1),J.adapter.smarter.Atom.isValidSymNoCase(d,
a)){this.elementSymbol=""+d+a;break}case 1:J.adapter.smarter.Atom.isValidSym1(d)&&(this.elementSymbol=""+d)}}return this.elementSymbol});c$.isValidSym1=c(c$,"isValidSym1",function(a){return"A"<=a&&"Z">=a&&0>J.adapter.smarter.Atom.elementCharMasks[a.charCodeAt(0)-65]},"~S");c$.isValidSym2=c(c$,"isValidSym2",function(a,b){return"A"<=a&&"Z">=a&&"a"<=b&&"z">=b&&0!=(J.adapter.smarter.Atom.elementCharMasks[a.charCodeAt(0)-65]>>b.charCodeAt(0)-97&1)},"~S,~S");c$.isValidSymNoCase=c(c$,"isValidSymNoCase",
function(a,b){return J.adapter.smarter.Atom.isValidSym2(a,"a">b?String.fromCharCode(b.charCodeAt(0)+32):b)},"~S,~S");c$.isValidSymChar1=c(c$,"isValidSymChar1",function(a){return"A"<=a&&"Z">=a&&0!=J.adapter.smarter.Atom.elementCharMasks[a.charCodeAt(0)-65]},"~S");c(c$,"copyTo",function(a,b){var d=b.newCloneAtom(this);d.setT(a);return d},"JU.P3,J.adapter.smarter.AtomSetCollection");E(c$,"elementCharMasks",B(-1,[1972292,-2147351151,-2146019271,-2130706430,1441792,-2147348464,25,-2147205008,-2147344384,
0,-2147352576,1179905,548936,-2147434213,-2147221504,-2145759221,0,1056947,-2147339946,-2147477097,-2147483648,-2147483648,-2147483648,8388624,-2147483646,139264]))});s("J.adapter.smarter");v(["J.api.JmolAdapterAtomIterator"],"J.adapter.smarter.AtomIterator",["java.lang.Float","J.api.JmolAdapter"],function(){c$=t(function(){this.iatom=0;this.atom=null;this.ac=0;this.bsAtoms=this.atoms=null;p(this,arguments)},J.adapter.smarter,"AtomIterator",null,J.api.JmolAdapterAtomIterator);q(c$,function(a){this.ac=
a.ac;this.atoms=a.atoms;this.bsAtoms=a.bsAtoms;this.iatom=0},"J.adapter.smarter.AtomSetCollection");j(c$,"hasNext",function(){if(this.iatom==this.ac)return!1;for(;null==(this.atom=this.atoms[this.iatom++])||null!=this.bsAtoms&&!this.bsAtoms.get(this.atom.index);)if(this.iatom==this.ac)return!1;this.atoms[this.iatom-1]=null;return!0});j(c$,"getAtomSetIndex",function(){return this.atom.atomSetIndex});j(c$,"getSymmetry",function(){return this.atom.bsSymmetry});j(c$,"getAtomSite",function(){return this.atom.atomSite+
1});j(c$,"getUniqueID",function(){return Integer.$valueOf(this.atom.index)});j(c$,"getElementNumber",function(){return 0<this.atom.elementNumber?this.atom.elementNumber:J.api.JmolAdapter.getElementNumber(this.atom.getElementSymbol())});j(c$,"getAtomName",function(){return this.atom.atomName});j(c$,"getFormalCharge",function(){return this.atom.formalCharge});j(c$,"getPartialCharge",function(){return this.atom.partialCharge});j(c$,"getTensors",function(){return this.atom.tensors});j(c$,"getRadius",
function(){return this.atom.radius});j(c$,"getBondRadius",function(){return this.atom.bondRadius});j(c$,"getVib",function(){return null==this.atom.vib||Float.isNaN(this.atom.vib.z)?null:this.atom.vib});j(c$,"getSeqID",function(){return null==this.atom.vib||!Float.isNaN(this.atom.vib.y)||1094713365!=this.atom.vib.z?0:A(this.atom.vib.x)});j(c$,"getBfactor",function(){return this.atom.bfactor});j(c$,"getOccupancy",function(){return 100*this.atom.foccupancy});j(c$,"getIsHetero",function(){return this.atom.isHetero});
j(c$,"getSerial",function(){return this.atom.atomSerial});j(c$,"getChainID",function(){return this.atom.chainID});j(c$,"getAltLoc",function(){return J.api.JmolAdapter.canonizeAlternateLocationID(this.atom.altLoc)});j(c$,"getGroup3",function(){return this.atom.group3});j(c$,"getSequenceNumber",function(){return this.atom.sequenceNumber});j(c$,"getInsertionCode",function(){return J.api.JmolAdapter.canonizeInsertionCode(this.atom.insertionCode)});j(c$,"getXYZ",function(){return this.atom})});s("J.adapter.smarter");
v(["java.util.Hashtable"],"J.adapter.smarter.AtomSetCollection","java.lang.Boolean $.Float java.util.Collections $.Properties JU.AU $.BS $.Lst $.P3 $.V3 J.adapter.smarter.Atom $.Bond $.SmarterJmolAdapter J.api.Interface JU.BSUtil $.Logger".split(" "),function(){c$=t(function(){this.atoms=this.atomSetInfo=this.collectionName=this.fileTypeName=this.bsAtoms=this.reader=null;this.ac=0;this.bonds=null;this.bondCount=0;this.structures=null;this.atomSetCount=this.structureCount=0;this.iSet=-1;this.errorMessage=
this.atomSetAuxiliaryInfo=this.atomSetBondCounts=this.atomSetAtomCounts=this.atomSetAtomIndexes=this.atomSetNumbers=null;this.isTrajectory=this.coordinatesAreFractional=!1;this.trajectoryStepCount=0;this.trajectoryNames=this.vibrationSteps=this.trajectorySteps=null;this.allowMultiple=this.doFixPeriodic=!1;this.readerList=null;this.atomMapAnyCase=!1;this.bsStructuredModels=null;this.haveAnisou=!1;this.baseSymmetryAtomCount=0;this.checkLatticeOnly=!1;this.xtalSymmetry=null;this.bondIndex0=0;this.checkSpecial=
!0;this.atomSymbolicMap=null;this.haveUnitCell=!1;this.vibScale=0;p(this,arguments)},J.adapter.smarter,"AtomSetCollection");O(c$,function(){this.atomSetInfo=new java.util.Hashtable;this.atoms=Array(256);this.bonds=Array(256);this.structures=Array(16);this.atomSetNumbers=B(16,0);this.atomSetAtomIndexes=B(16,0);this.atomSetAtomCounts=B(16,0);this.atomSetBondCounts=B(16,0);this.atomSetAuxiliaryInfo=Array(16);this.atomSymbolicMap=new java.util.Hashtable});c(c$,"setCollectionName",function(a){if(null!=
a&&0<(a=a.trim()).length)this.collectionName=a},"~S");c(c$,"clearGlobalBoolean",function(a){this.atomSetInfo.remove(J.adapter.smarter.AtomSetCollection.globalBooleans[a])},"~N");c(c$,"setGlobalBoolean",function(a){this.setInfo(J.adapter.smarter.AtomSetCollection.globalBooleans[a],Boolean.TRUE)},"~N");c(c$,"getGlobalBoolean",function(a){return this.atomSetInfo.get(J.adapter.smarter.AtomSetCollection.globalBooleans[a])===Boolean.TRUE},"~N");q(c$,function(a,b,d,g){this.fileTypeName=a;this.reader=b;this.allowMultiple=
null==b||0>b.desiredVibrationNumber;a=new java.util.Properties;a.put("PATH_KEY",".PATH");a.put("PATH_SEPARATOR",J.adapter.smarter.SmarterJmolAdapter.PATH_SEPARATOR);this.setInfo("properties",a);b=null==b?null:b.htParams.get("appendToModelIndex");null!=b&&this.setInfo("appendToModelIndex",b);if(null!=d){g=0;this.readerList=new JU.Lst;for(b=0;b<d.length;b++)null!=d[b]&&(0<d[b].ac||null!=d[b].reader&&d[b].reader.mustFinalizeModelSet)&&this.appendAtomSetCollection(g++,d[b]);1<g&&this.setInfo("isMultiFile",
Boolean.TRUE)}else null!=g&&(this.setInfo("isMultiFile",Boolean.TRUE),this.appendAtomSetCollectionList(g))},"~S,J.adapter.smarter.AtomSetCollectionReader,~A,JU.Lst");c(c$,"appendAtomSetCollectionList",function(a){var b=a.size();if(0==b)this.errorMessage="No file found!";else for(var d=0;d<b;d++){var g=a.get(d);n(g,JU.Lst)?this.appendAtomSetCollectionList(g):this.appendAtomSetCollection(d,g)}},"JU.Lst");c(c$,"setTrajectory",function(){this.isTrajectory||(this.trajectorySteps=new JU.Lst);this.isTrajectory=
!0;var a=null==this.bsAtoms?this.ac:this.bsAtoms.cardinality();if(!(1>=a)){for(var b=Array(a),d=0<a&&null!=this.atoms[0].vib&&!Float.isNaN(this.atoms[0].vib.z),a=d?Array(a):null,g=0==this.trajectoryStepCount?null:this.trajectorySteps.get(this.trajectoryStepCount-1),c=0,e=0;c<this.ac;c++)if(null==this.bsAtoms||this.bsAtoms.get(c)){var h=JU.P3.newP(this.atoms[c]);this.doFixPeriodic&&null!=g&&(h=J.adapter.smarter.AtomSetCollection.fixPeriodic(h,g[c]));b[e]=h;d&&(a[e]=this.atoms[c].vib);e++}if(d){if(null==
this.vibrationSteps){this.vibrationSteps=new JU.Lst;for(c=0;c<this.trajectoryStepCount;c++)this.vibrationSteps.addLast(null)}this.vibrationSteps.addLast(a)}this.trajectorySteps.addLast(b);this.trajectoryStepCount++}});c(c$,"appendAtomSetCollection",function(a,b){null!=b.reader&&b.reader.mustFinalizeModelSet&&this.readerList.addLast(b.reader);var d=this.ac;this.setInfo("loadState",b.atomSetInfo.get("loadState"));if(null!=b.bsAtoms){null==this.bsAtoms&&(this.bsAtoms=new JU.BS);for(var g=b.bsAtoms.nextSetBit(0);0<=
g;g=b.bsAtoms.nextSetBit(g+1))this.bsAtoms.set(d+g)}for(var g=0,c=this.atomSetCount,e=0;e<b.atomSetCount;e++){this.newAtomSet();var h=(this.atomSetAuxiliaryInfo[this.iSet]=b.atomSetAuxiliaryInfo[e]).get("PDB_CONECT_firstAtom_count_max");null!=h&&(h[0]+=d);this.setCurrentModelInfo("title",b.collectionName);this.setAtomSetName(b.getAtomSetName(e));for(h=0;h<b.atomSetAtomCounts[e];h++)null!=this.bsAtoms&&this.bsAtoms.set(this.ac),this.newCloneAtom(b.atoms[g]),g++;this.atomSetNumbers[this.iSet]=0>a?this.iSet+
1:1E6*(a+1)+b.atomSetNumbers[e]}for(g=0;g<b.bondCount;g++)e=b.bonds[g],this.addNewBondWithOrder(e.atomIndex1+d,e.atomIndex2+d,e.order);for(g=J.adapter.smarter.AtomSetCollection.globalBooleans.length;0<=--g;)b.getGlobalBoolean(g)&&this.setGlobalBoolean(g);for(g=0;g<b.structureCount;g++)d=b.structures[g],this.addStructure(d),d.modelStartEnd[0]+=c,d.modelStartEnd[1]+=c},"~N,J.adapter.smarter.AtomSetCollection");c(c$,"setNoAutoBond",function(){this.setInfo("noAutoBond",Boolean.TRUE)});c(c$,"freeze",function(a){1==
this.atomSetCount&&null==this.collectionName&&(this.collectionName=this.getAtomSetAuxiliaryInfoValue(0,"name"));a&&this.reverseAtomSets();1<this.trajectoryStepCount&&this.finalizeTrajectory();this.getList(!0);this.getList(!1);for(a=0;a<this.atomSetCount;a++)this.setModelInfoForSet("initialAtomCount",Integer.$valueOf(this.atomSetAtomCounts[a]),a),this.setModelInfoForSet("initialBondCount",Integer.$valueOf(this.atomSetBondCounts[a]),a)},"~B");c(c$,"reverseAtomSets",function(){this.reverseArray(this.atomSetAtomIndexes);
this.reverseArray(this.atomSetNumbers);this.reverseArray(this.atomSetAtomCounts);this.reverseArray(this.atomSetBondCounts);J.adapter.smarter.AtomSetCollection.reverseList(this.trajectorySteps);J.adapter.smarter.AtomSetCollection.reverseList(this.trajectoryNames);J.adapter.smarter.AtomSetCollection.reverseList(this.vibrationSteps);this.reverseObject(this.atomSetAuxiliaryInfo);for(var a=0;a<this.ac;a++)this.atoms[a].atomSetIndex=this.atomSetCount-1-this.atoms[a].atomSetIndex;for(a=0;a<this.structureCount;a++){var b=
this.structures[a].modelStartEnd[0];0<=b&&(this.structures[a].modelStartEnd[0]=this.atomSetCount-1-this.structures[a].modelStartEnd[1],this.structures[a].modelStartEnd[1]=this.atomSetCount-1-b)}for(a=0;a<this.bondCount;a++)this.bonds[a].atomSetIndex=this.atomSetCount-1-this.atoms[this.bonds[a].atomIndex1].atomSetIndex;this.reverseSets(this.bonds,this.bondCount);for(var d=JU.AU.createArrayOfArrayList(this.atomSetCount),a=0;a<this.atomSetCount;a++)d[a]=new JU.Lst;for(a=0;a<this.ac;a++)d[this.atoms[a].atomSetIndex].addLast(this.atoms[a]);
for(var b=B(this.ac,0),g=this.ac,a=this.atomSetCount;0<=--a;)for(var c=d[a].size();0<=--c;){var e=this.atoms[--g]=d[a].get(c);b[e.index]=g;e.index=g}for(a=0;a<this.bondCount;a++)this.bonds[a].atomIndex1=b[this.bonds[a].atomIndex1],this.bonds[a].atomIndex2=b[this.bonds[a].atomIndex2];for(a=0;a<this.atomSetCount;a++)d=this.getAtomSetAuxiliaryInfoValue(a,"PDB_CONECT_firstAtom_count_max"),null!=d&&(d[0]=b[d[0]],d[1]=this.atomSetAtomCounts[a])});c(c$,"reverseSets",function(a,b){for(var d=JU.AU.createArrayOfArrayList(this.atomSetCount),
g=0;g<this.atomSetCount;g++)d[g]=new JU.Lst;for(g=0;g<b;g++){if(0>a[g].atomSetIndex)return;d[a[g].atomSetIndex].addLast(a[g])}for(g=this.atomSetCount;0<=--g;)for(var c=d[g].size();0<=--c;)a[--b]=d[g].get(c)},"~A,~N");c(c$,"reverseObject",function(a){for(var b=this.atomSetCount,d=w(b/2);0<=--d;)JU.AU.swap(a,d,b-1-d)},"~A");c$.reverseList=c(c$,"reverseList",function(a){null!=a&&java.util.Collections.reverse(a)},"JU.Lst");c(c$,"reverseArray",function(a){for(var b=this.atomSetCount,d=w(b/2);0<=--d;)JU.AU.swapInt(a,
d,b-1-d)},"~A");c(c$,"getList",function(a){var b;for(b=this.ac;0<=--b&&!(null!=this.atoms[b]&&"\x00"!=(a?this.atoms[b].altLoc:this.atoms[b].insertionCode)););if(!(0>b)){var d=Array(this.atomSetCount);for(b=0;b<this.atomSetCount;b++)d[b]="";var g;for(b=0;b<this.ac;b++)if(null!=this.atoms[b]){var c=a?this.atoms[b].altLoc:this.atoms[b].insertionCode;if("\x00"!=c&&0>d[g=this.atoms[b].atomSetIndex].indexOf(c))d[g]+=c}a=a?"altLocs":"insertionCodes";for(b=0;b<this.atomSetCount;b++)0<d[b].length&&this.setModelInfoForSet(a,
d[b],b)}},"~B");c(c$,"finish",function(){if(null!=this.reader)this.reader.finalizeModelSet();else if(null!=this.readerList)for(var a=0;a<this.readerList.size();a++)this.readerList.get(a).finalizeModelSet();this.atoms=null;this.atomSetAtomCounts=B(16,0);this.atomSetAuxiliaryInfo=Array(16);this.atomSetInfo=new java.util.Hashtable;this.atomSetCount=0;this.atomSetNumbers=B(16,0);this.atomSymbolicMap=new java.util.Hashtable;this.bonds=null;this.iSet=-1;this.xtalSymmetry=this.readerList=null;this.structures=
Array(16);this.structureCount=0;this.vibrationSteps=this.trajectorySteps=null});c(c$,"discardPreviousAtoms",function(){for(var a=this.ac;0<=--a;)this.atoms[a]=null;this.ac=0;this.atomSymbolicMap.clear();this.atomMapAnyCase=!1;this.atomSetCount=0;this.iSet=-1;for(a=this.atomSetAuxiliaryInfo.length;0<=--a;)this.atomSetAtomCounts[a]=0,this.atomSetBondCounts[a]=0,this.atomSetAuxiliaryInfo[a]=null});c(c$,"removeCurrentAtomSet",function(){if(!(0>this.iSet)){var a=this.atomSetAtomIndexes[this.iSet];null!=
this.bsAtoms&&this.bsAtoms.clearBits(a,this.ac);this.ac=a;this.atomSetAtomCounts[this.iSet]=0;this.iSet--;this.atomSetCount--;this.reader.doCheckUnitCell=!1}});c(c$,"getHydrogenAtomCount",function(){for(var a=0,b=0;b<this.ac;b++)(1==this.atoms[b].elementNumber||this.atoms[b].elementSymbol.equals("H"))&&a++;return a});c(c$,"newCloneAtom",function(a){a=a.getClone();this.addAtom(a);return a},"J.adapter.smarter.Atom");c(c$,"cloneFirstAtomSet",function(a){if(!this.allowMultiple)return 0;this.newAtomSet();
0==a&&(a=this.atomSetAtomCounts[0]);for(var b=0;b<a;++b)this.newCloneAtom(this.atoms[b]);return this.ac},"~N");c(c$,"cloneAtomSetWithBonds",function(a){var b=this.atomSetBondCounts[a?this.iSet:0];a=a?this.cloneLastAtomSet():this.cloneFirstAtomSet(0);if(0<a)for(var d=0;d<b;d++){var g=this.bonds[this.bondCount-b];this.addNewBondWithOrder(g.atomIndex1+a,g.atomIndex2+a,g.order)}},"~B");c(c$,"cloneLastAtomSet",function(){return this.cloneLastAtomSetFromPoints(0,null)});c(c$,"cloneLastAtomSetFromPoints",
function(a,b){if(!this.allowMultiple)return 0;var d=0<a?a:this.getLastAtomSetAtomCount(),g=this.getLastAtomSetAtomIndex();this.newAtomSet();for(var c=0;c<d;++c){var e=this.newCloneAtom(this.atoms[g++]);null!=b&&e.setT(b[c])}return d},"~N,~A");c(c$,"getLastAtomSetAtomCount",function(){return this.atomSetAtomCounts[this.iSet]});c(c$,"getLastAtomSetAtomIndex",function(){return this.ac-this.atomSetAtomCounts[this.iSet]});c(c$,"addNewAtom",function(){return this.addAtom(new J.adapter.smarter.Atom)});c(c$,
"addAtom",function(a){this.ac==this.atoms.length&&(this.atoms=2E5<this.ac?JU.AU.ensureLength(this.atoms,this.ac+5E4):JU.AU.doubleLength(this.atoms));0==this.atomSetCount&&this.newAtomSet();a.index=this.ac;this.atoms[this.ac++]=a;a.atomSetIndex=this.iSet;a.atomSite=this.atomSetAtomCounts[this.iSet]++;return a},"J.adapter.smarter.Atom");c(c$,"addAtomWithMappedName",function(a){var b=this.addAtom(a).atomName;null!=b&&this.atomSymbolicMap.put(b,a)},"J.adapter.smarter.Atom");c(c$,"addAtomWithMappedSerialNumber",
function(a){var b=this.addAtom(a).atomSerial;-2147483648!=b&&this.atomSymbolicMap.put(""+b,a)},"J.adapter.smarter.Atom");c(c$,"getAtomFromName",function(a){return this.atomSymbolicMap.get(a)},"~S");c(c$,"setAtomMapAnyCase",function(){this.atomMapAnyCase=!0;var a=new java.util.Hashtable;a.putAll(this.atomSymbolicMap);for(var b,d=this.atomSymbolicMap.entrySet().iterator();d.hasNext()&&((b=d.next())||1);){var g=b.getKey(),c=g.toUpperCase();c.equals(g)||a.put(c,b.getValue())}this.atomSymbolicMap=a});
c(c$,"getAtomIndex",function(a){var b=this.atomSymbolicMap.get(a);null==b&&this.atomMapAnyCase&&(b=this.atomSymbolicMap.get(a.toUpperCase()));return null==b?-1:b.index},"~S");c(c$,"addNewBondWithOrder",function(a,b,d){var g=null;0<=a&&(a<this.ac&&0<=b&&b<this.ac&&a!=b)&&(g=new J.adapter.smarter.Bond(a,b,d),this.addBond(g));return g},"~N,~N,~N");c(c$,"addNewBondFromNames",function(a,b,d){this.addNewBondWithOrderA(this.getAtomFromName(a),this.getAtomFromName(b),d)},"~S,~S,~N");c(c$,"addNewBondWithOrderA",
function(a,b,d){null!=a&&null!=b&&this.addNewBondWithOrder(a.index,b.index,d)},"J.adapter.smarter.Atom,J.adapter.smarter.Atom,~N");c(c$,"addBond",function(a){0<this.trajectoryStepCount||(0>a.atomIndex1||0>a.atomIndex2||0>a.order||a.atomIndex1==a.atomIndex2||this.atoms[a.atomIndex1].atomSetIndex!=this.atoms[a.atomIndex2].atomSetIndex?JU.Logger.debugging&&JU.Logger.debug(">>>>>>BAD BOND:"+a.atomIndex1+"-"+a.atomIndex2+" order="+a.order):(this.bondCount==this.bonds.length&&(this.bonds=JU.AU.arrayCopyObject(this.bonds,
this.bondCount+1024)),this.bonds[this.bondCount++]=a,this.atomSetBondCounts[this.iSet]++))},"J.adapter.smarter.Bond");c(c$,"finalizeStructures",function(){if(0!=this.structureCount){this.bsStructuredModels=new JU.BS;for(var a=new java.util.Hashtable,b=0;b<this.structureCount;b++){var d=this.structures[b];-1==d.modelStartEnd[0]&&(d.modelStartEnd[0]=0,d.modelStartEnd[1]=this.atomSetCount-1);this.bsStructuredModels.setBits(d.modelStartEnd[0],d.modelStartEnd[1]+1);if(0!=d.strandCount){var d=d.structureID+
" "+d.modelStartEnd[0],g=a.get(d),g=(null==g?0:g.intValue())+1;a.put(d,Integer.$valueOf(g))}}for(b=0;b<this.structureCount;b++)d=this.structures[b],1==d.strandCount&&(d.strandCount=a.get(d.structureID+" "+d.modelStartEnd[0]).intValue())}});c(c$,"addStructure",function(a){this.structureCount==this.structures.length&&(this.structures=JU.AU.arrayCopyObject(this.structures,this.structureCount+32));this.structures[this.structureCount++]=a},"J.adapter.smarter.Structure");c(c$,"addVibrationVectorWithSymmetry",
function(a,b,d,g,c){if(c){c=this.atoms[a].atomSite;for(var e=this.atoms[a].atomSetIndex;a<this.ac&&this.atoms[a].atomSetIndex==e;a++)this.atoms[a].atomSite==c&&this.addVibrationVector(a,b,d,g)}else this.addVibrationVector(a,b,d,g)},"~N,~N,~N,~N,~B");c(c$,"addVibrationVector",function(a,b,d,g){this.allowMultiple||(a%=this.ac);return this.atoms[a].vib=JU.V3.new3(b,d,g)},"~N,~N,~N,~N");c(c$,"setCoordinatesAreFractional",function(a){this.coordinatesAreFractional=a;this.setCurrentModelInfo("coordinatesAreFractional",
Boolean.$valueOf(a));a&&this.setGlobalBoolean(0)},"~B");c(c$,"setAnisoBorU",function(a,b,d){this.haveAnisou=!0;a.anisoBorU=b;b[6]=d},"J.adapter.smarter.Atom,~A,~N");c(c$,"setU",function(a,b,d){var g=a.anisoBorU;null==g&&this.setAnisoBorU(a,g=K(8,0),8);g[b]=d},"J.adapter.smarter.Atom,~N,~N");c(c$,"getXSymmetry",function(){null==this.xtalSymmetry&&(this.xtalSymmetry=J.api.Interface.getOption("adapter.smarter.XtalSymmetry",this.reader.vwr,"file").set(this.reader));return this.xtalSymmetry});c(c$,"getSymmetry",
function(){return this.getXSymmetry().getSymmetry()});c(c$,"setSymmetry",function(a){return null==a?null:this.getXSymmetry().setSymmetry(a)},"J.api.SymmetryInterface");c(c$,"setTensors",function(){this.haveAnisou&&this.getXSymmetry().setTensors()});c(c$,"setInfo",function(a,b){null==b?this.atomSetInfo.remove(a):this.atomSetInfo.put(a,b)},"~S,~O");c(c$,"setAtomSetCollectionPartialCharges",function(a){if(!this.atomSetInfo.containsKey(a))return!1;for(var b=this.atomSetInfo.get(a),d=b.size(),g=this.ac;0<=
--g;)this.atoms[g].partialCharge=b.get(g%d).floatValue();JU.Logger.info("Setting partial charges type "+a);return!0},"~S");c(c$,"mapPartialCharge",function(a,b){this.getAtomFromName(a).partialCharge=b},"~S,~N");c$.fixPeriodic=c(c$,"fixPeriodic",function(a,b){a.x=J.adapter.smarter.AtomSetCollection.fixPoint(a.x,b.x);a.y=J.adapter.smarter.AtomSetCollection.fixPoint(a.y,b.y);a.z=J.adapter.smarter.AtomSetCollection.fixPoint(a.z,b.z);return a},"JU.P3,JU.P3");c$.fixPoint=c(c$,"fixPoint",function(a,b){for(;0.9<
a-b;)a-=1;for(;-0.9>a-b;)a+=1;return a},"~N,~N");c(c$,"finalizeTrajectoryAs",function(a,b){this.trajectorySteps=a;this.vibrationSteps=b;this.trajectoryStepCount=a.size();this.finalizeTrajectory()},"JU.Lst,JU.Lst");c(c$,"finalizeTrajectory",function(){if(0!=this.trajectoryStepCount){var a=this.trajectorySteps.get(0),b=null==this.vibrationSteps?null:this.vibrationSteps.get(0),d=null==this.bsAtoms?this.ac:this.bsAtoms.cardinality();if(null!=this.vibrationSteps&&null!=b&&b.length<d||a.length<d)this.errorMessage=
"File cannot be loaded as a trajectory";else{for(var d=new JU.V3,g=0,c=0;g<this.ac;g++)if(null==this.bsAtoms||this.bsAtoms.get(g))null!=this.vibrationSteps&&(this.atoms[g].vib=null==b?d:b[c]),null!=a[c]&&this.atoms[g].setT(a[c]),c++;this.setInfo("trajectorySteps",this.trajectorySteps);null!=this.vibrationSteps&&this.setInfo("vibrationSteps",this.vibrationSteps);0==this.ac&&(this.ac=a.length)}}});c(c$,"newAtomSet",function(){this.newAtomSetClear(!0)});c(c$,"newAtomSetClear",function(a){!this.allowMultiple&&
0<=this.iSet&&this.reader.discardPreviousAtoms();this.bondIndex0=this.bondCount;this.isTrajectory&&this.reader.discardPreviousAtoms();this.iSet=this.atomSetCount++;this.atomSetCount>this.atomSetNumbers.length&&(this.atomSetAtomIndexes=JU.AU.doubleLengthI(this.atomSetAtomIndexes),this.atomSetAtomCounts=JU.AU.doubleLengthI(this.atomSetAtomCounts),this.atomSetBondCounts=JU.AU.doubleLengthI(this.atomSetBondCounts),this.atomSetAuxiliaryInfo=JU.AU.doubleLength(this.atomSetAuxiliaryInfo));this.atomSetAtomIndexes[this.iSet]=
this.ac;this.atomSetCount+this.trajectoryStepCount>this.atomSetNumbers.length&&(this.atomSetNumbers=JU.AU.doubleLengthI(this.atomSetNumbers));this.isTrajectory?this.atomSetNumbers[this.iSet+this.trajectoryStepCount]=this.atomSetCount+this.trajectoryStepCount:this.atomSetNumbers[this.iSet]=this.atomSetCount;a&&(this.atomSymbolicMap.clear(),this.atomMapAnyCase=!1);this.setCurrentModelInfo("title",this.collectionName)},"~B");c(c$,"getAtomSetAtomIndex",function(a){0>a&&System.out.println("??");return this.atomSetAtomIndexes[a]},
"~N");c(c$,"getAtomSetAtomCount",function(a){return this.atomSetAtomCounts[a]},"~N");c(c$,"getAtomSetBondCount",function(a){return this.atomSetBondCounts[a]},"~N");c(c$,"setAtomSetName",function(a){if(null!=a)if(this.isTrajectory)this.setTrajectoryName(a);else{var b=0>this.iSet?null:this.getAtomSetName(this.iSet);this.setModelInfoForSet("name",a,this.iSet);null!=this.reader&&(0<a.length&&!a.equals(b))&&this.reader.appendLoadNote(a);this.allowMultiple||this.setCollectionName(a)}},"~S");c(c$,"setTrajectoryName",
function(a){if(0!=this.trajectoryStepCount){null==this.trajectoryNames&&(this.trajectoryNames=new JU.Lst);for(var b=this.trajectoryNames.size();b<this.trajectoryStepCount;b++)this.trajectoryNames.addLast(null);this.trajectoryNames.set(this.trajectoryStepCount-1,a)}},"~S");c(c$,"setCurrentAtomSetNumber",function(a){this.setAtomSetNumber(this.iSet+(this.isTrajectory?this.trajectoryStepCount:0),a)},"~N");c(c$,"setAtomSetNumber",function(a,b){this.atomSetNumbers[a]=b},"~N,~N");c(c$,"setAtomSetModelProperty",
function(a,b){this.setAtomSetModelPropertyForSet(a,b,this.iSet)},"~S,~S");c(c$,"setAtomSetModelPropertyForSet",function(a,b,d){var g=this.getAtomSetAuxiliaryInfoValue(d,"modelProperties");null==g&&this.setModelInfoForSet("modelProperties",g=new java.util.Properties,d);g.put(a,b);a.startsWith(".")&&g.put(a.substring(1),b)},"~S,~S,~N");c(c$,"setAtomProperties",function(a,b,d){n(b,String)&&!b.endsWith("\n")&&(b+="\n");0>d&&(d=this.iSet);var g=this.getAtomSetAuxiliaryInfoValue(d,"atomProperties");null==
g&&this.setModelInfoForSet("atomProperties",g=new java.util.Hashtable,d);g.put(a,b)},"~S,~O,~N,~B");c(c$,"setAtomSetPartialCharges",function(a){if(!this.atomSetAuxiliaryInfo[this.iSet].containsKey(a))return!1;a=this.getAtomSetAuxiliaryInfoValue(this.iSet,a);for(var b=a.size();0<=--b;)this.atoms[b].partialCharge=a.get(b).floatValue();return!0},"~S");c(c$,"getAtomSetAuxiliaryInfoValue",function(a,b){return this.atomSetAuxiliaryInfo[0<=a?a:this.iSet].get(b)},"~N,~S");c(c$,"setCurrentModelInfo",function(a,
b){this.setModelInfoForSet(a,b,this.iSet)},"~S,~O");c(c$,"setModelInfoForSet",function(a,b,d){0>d||(null==this.atomSetAuxiliaryInfo[d]&&(this.atomSetAuxiliaryInfo[d]=new java.util.Hashtable),null==b?this.atomSetAuxiliaryInfo[d].remove(a):this.atomSetAuxiliaryInfo[d].put(a,b))},"~S,~O,~N");c(c$,"getAtomSetNumber",function(a){return this.atomSetNumbers[a>=this.atomSetCount?0:a]},"~N");c(c$,"getAtomSetName",function(a){if(null!=this.trajectoryNames&&a<this.trajectoryNames.size())return this.trajectoryNames.get(a);
a>=this.atomSetCount&&(a=this.atomSetCount-1);return this.getAtomSetAuxiliaryInfoValue(a,"name")},"~N");c(c$,"getAtomSetAuxiliaryInfo",function(a){a=a>=this.atomSetCount?this.atomSetCount-1:a;return 0>a?null:this.atomSetAuxiliaryInfo[a]},"~N");c(c$,"setAtomSetEnergy",function(a,b){0>this.iSet||(JU.Logger.info("Energy for model "+(this.iSet+1)+" = "+a),this.setCurrentModelInfo("EnergyString",a),this.setCurrentModelInfo("Energy",Float.$valueOf(b)),this.setAtomSetModelProperty("Energy",""+b))},"~S,~N");
c(c$,"setAtomSetFrequency",function(a,b,d,g,c){this.setAtomSetModelProperty("FreqValue",g);g+=" "+(null==c?"cm^-1":c);c=(null==d?"":d+" ")+g;this.setAtomSetName(c);this.setAtomSetModelProperty("Frequency",g);this.setAtomSetModelProperty("Mode",""+a);this.setModelInfoForSet("vibrationalMode",Integer.$valueOf(a),this.iSet);null!=d&&this.setAtomSetModelProperty("FrequencyLabel",d);this.setAtomSetModelProperty(".PATH",(null==b?"":b+J.adapter.smarter.SmarterJmolAdapter.PATH_SEPARATOR+"Frequencies")+"Frequencies");
return c},"~N,~S,~S,~S,~S");c(c$,"getBondList",function(){for(var a=Array(this.bondCount),b=0;b<this.bondCount;b++)a[b]=u(-1,[this.atoms[this.bonds[b].atomIndex1].atomName,this.atoms[this.bonds[b].atomIndex2].atomName,""+this.bonds[b].order]);return a});c(c$,"centralize",function(){for(var a=new JU.P3,b=0;b<this.atomSetCount;b++){var d=this.atomSetAtomCounts[b],g=this.atomSetAtomIndexes[b];a.set(0,0,0);for(var c=g+d;--c>=g;)a.add(this.atoms[c]);a.scale(1/d);for(c=g+d;--c>=g;)this.atoms[c].sub(a)}});
c(c$,"mergeTrajectories",function(a){if(this.isTrajectory&&a.isTrajectory&&null==this.vibrationSteps){for(var b=0;b<a.trajectoryStepCount;b++)this.trajectorySteps.add(this.trajectoryStepCount++,a.trajectorySteps.get(b));this.setInfo("trajectorySteps",this.trajectorySteps);this.setInfo("ignoreUnitCell",a.atomSetInfo.get("ignoreUnitCell"))}},"J.adapter.smarter.AtomSetCollection");c(c$,"removeAtomSet",function(a){null==this.bsAtoms&&(this.bsAtoms=JU.BSUtil.newBitSet2(0,this.ac));var b=this.atomSetAtomIndexes[a],
d=b+this.atomSetAtomCounts[a];this.bsAtoms.clearBits(b,d);for(b=d;b<this.ac;b++)this.atoms[b].atomSetIndex--;for(b=a+1;b<this.atomSetCount;b++)this.atomSetAuxiliaryInfo[b-1]=this.atomSetAuxiliaryInfo[b],this.atomSetAtomIndexes[b-1]=this.atomSetAtomIndexes[b],this.atomSetBondCounts[b-1]=this.atomSetBondCounts[b],this.atomSetAtomCounts[b-1]=this.atomSetAtomCounts[b],this.atomSetNumbers[b-1]=this.atomSetNumbers[b];for(b=0;b<this.bondCount;b++)this.bonds[b].atomSetIndex=this.atoms[this.bonds[b].atomIndex1].atomSetIndex;
this.atomSetAuxiliaryInfo[--this.atomSetCount]=null;for(b=d=0;b<this.structureCount;b++){var g=this.structures[b];g.modelStartEnd[0]==a&&g.modelStartEnd[1]==a&&(this.structures[b]=null,d++)}if(0<d){a=Array(this.structureCount-d);for(d=b=0;b<this.structureCount;b++)null!=this.structures[b]&&(a[d++]=this.structures[b]);this.structures=a}},"~N");c(c$,"removeLastUnselectedAtoms",function(){for(var a=this.ac,b=0,d=this.getLastAtomSetAtomIndex(),g=0,c=d;c<a;c++)this.bsAtoms.get(c)?(0<b&&(this.atoms[this.atoms[c].index=
c-b]=this.atoms[c],this.atoms[c]=null),g++):(b++,this.ac--,this.atoms[c]=null);this.atomSetAtomCounts[this.iSet]=g;0==g?(this.iSet--,this.atomSetCount--):this.bsAtoms.setBits(d,d+g)});c(c$,"checkNoEmptyModel",function(){for(;0<this.atomSetCount&&0==this.atomSetAtomCounts[this.atomSetCount-1];)this.atomSetCount--});E(c$,"globalBooleans",u(-1,"someModelsHaveFractionalCoordinates someModelsHaveSymmetry someModelsHaveUnitcells someModelsHaveCONECT isPDB someModelsHaveDomains someModelsHaveValidations".split(" ")),
"GLOBAL_FRACTCOORD",0,"GLOBAL_SYMMETRY",1,"GLOBAL_UNITCELLS",2,"GLOBAL_CONECT",3,"GLOBAL_ISPDB",4,"GLOBAL_DOMAINS",5,"GLOBAL_VALIDATIONS",6)});s("J.adapter.smarter");v(["javajs.api.GenericLineReader","JU.SB"],"J.adapter.smarter.AtomSetCollectionReader","java.io.BufferedReader java.lang.Boolean $.Double $.Float $.NullPointerException javajs.api.GenericBinaryDocument JU.BS $.Lst $.M3 $.P3 $.PT $.Quat $.T4 $.V3 J.adapter.smarter.Atom $.AtomSetCollection J.api.Interface $.JmolAdapter JU.BSUtil $.Logger".split(" "),
function(){c$=t(function(){this.requiresBSFilter=this.debugging=this.isBinary=!1;this.dssr=this.validation=this.domains=this.trajectorySteps=this.htParams=this.readerName=this.binaryDoc=this.reader=this.asc=this.primitiveToCrystal=null;this.isConcatenated=!1;this.addedDataKey=this.addedData=null;this.fixJavaFloat=!0;this.next=this.prevline=this.line=this.lstNCS=this.thisBiomolecule=null;this.ptLine=0;this.fillRange=this.latticeCells=this.latticeType=null;this.iHaveSymmetryOperators=this.iHaveUnitCell=
this.doProcessLines=!1;this.continuing=!0;this.vwr=null;this.isMolecular=this.isSequential=this.getHeader=this.doCheckUnitCell=this.applySymmetryToBonds=this.isTrajectory=this.ignoreFileSymmetryOperators=this.doApplySymmetry=!1;this.vibrationNumber=this.modelNumber=this.templateAtomCount=0;this.desiredVibrationNumber=-2147483648;this.bsModels=null;this.havePartialChargeFilter=this.useFileModelNumbers=!1;this.calculationType="?";this.sgName=null;this.ignoreFileSpaceGroupName=this.ignoreFileUnitCell=
!1;this.unitCellParams=null;this.desiredModelNumber=-2147483648;this.out=this.symmetry=null;this.doPackUnitCell=this.iHaveFractionalCoordinates=!1;this.ptSupercell=null;this.forcePacked=this.mustFinalizeModelSet=!1;this.packingError=0.02;this.isPrimitive=this.rotateHexCell=!1;this.modDim=0;this.loadNote=null;this.merging=this.fileCoordinatesAreFractional=this.doConvertToFractional=!1;this.symmetryRange=0;this.firstLastStep=null;this.lastModelNumber=2147483647;this.desiredSpaceGroupIndex=-1;this.fileScaling=
null;this.latticeScaling=NaN;this.unitCellOffset=this.fileOffsetFractional=this.fileOffset=null;this.unitCellOffsetFractional=!1;this.paramsLattice=this.moreUnitCellInfo=null;this.paramsPacked=this.paramsCentroid=!1;this.fileName=this.filePath=null;this.baseBondIndex=this.baseAtomIndex=0;this.stateScriptVersionInt=2147483647;this.haveModel=this.isFinalized=!1;this.previousUnitCell=this.previousSpaceGroup=null;this.nMatrixElements=0;this.filter=this.bsFilter=this.matUnitCellOrientation=this.ucItems=
null;this.filterAtomType=this.filterAtomName=this.filterChain=this.filterGroup3=this.filterAltLoc=this.haveAtomFilter=!1;this.filterAtomTypeStr=null;this.filterAtomNameTerminator=";";this.filterEveryNth=this.filterHetero=this.filterElement=!1;this.filterSymop=null;this.nFiltered=this.filterN=0;this.reverseModels=this.doReadMolecularOrbitals=this.allowPDBFilter=this.isDSSP1=this.ignoreStructure=this.useAltNames=this.addVibrations=this.doCentralize=this.doSetOrientation=!1;this.nameRequired=null;this.centroidPacked=
this.doCentroidUnitCell=!1;this.strSupercell=null;this.allow_a_len_1=!1;this.ms=this.matRot=this.filter2=this.filter1=null;this.vibsFractional=!1;this.siteScript=this.previousScript=null;p(this,arguments)},J.adapter.smarter,"AtomSetCollectionReader",null,javajs.api.GenericLineReader);O(c$,function(){this.next=B(1,0);this.loadNote=new JU.SB});c(c$,"setup",function(a,b,d){this.setupASCR(a,b,d)},"~S,java.util.Map,~O");c(c$,"setupASCR",function(a,b,d){null!=a&&(this.debugging=JU.Logger.debugging,this.htParams=
b,this.filePath=""+b.get("fullPathName"),a=this.filePath.lastIndexOf("/"),this.fileName=this.filePath.substring(a+1),n(d,java.io.BufferedReader)?this.reader=d:n(d,javajs.api.GenericBinaryDocument)&&(this.binaryDoc=d))},"~S,java.util.Map,~O");c(c$,"readData",function(){this.initialize();this.asc=new J.adapter.smarter.AtomSetCollection(this.readerName,this,null,null);try{this.initializeReader();if(null==this.binaryDoc)for(null==this.line&&this.continuing&&this.rd();null!=this.line&&this.continuing;)this.checkLine()&&
this.rd();else this.binaryDoc.setOutputChannel(this.out),this.processBinaryDocument();this.finalizeSubclassReader();this.isFinalized||this.finalizeReaderASCR()}catch(a){JU.Logger.info("Reader error: "+a),a.printStackTrace(),this.setError(a)}null!=this.reader&&this.reader.close();null!=this.binaryDoc&&this.binaryDoc.close();return this.finish()});c(c$,"fixBaseIndices",function(){try{var a=this.htParams.get("baseModelIndex").intValue();this.baseAtomIndex+=this.asc.ac;this.baseBondIndex+=this.asc.bondCount;
a+=this.asc.atomSetCount;this.htParams.put("baseAtomIndex",Integer.$valueOf(this.baseAtomIndex));this.htParams.put("baseBondIndex",Integer.$valueOf(this.baseBondIndex));this.htParams.put("baseModelIndex",Integer.$valueOf(a))}catch(b){if(!H(b,Exception))throw b;}});c(c$,"readDataObject",function(a){this.initialize();this.asc=new J.adapter.smarter.AtomSetCollection(this.readerName,this,null,null);this.initializeReader();this.processDOM(a);return this.finish()},"~O");c(c$,"processDOM",function(){},"~O");
c(c$,"processBinaryDocument",function(){});c(c$,"initializeReader",function(){});c(c$,"checkLine",function(){return!0});c(c$,"checkLastModel",function(){if(this.isLastModel(this.modelNumber)&&this.doProcessLines)return this.continuing=this.doProcessLines=!1;this.doProcessLines=!1;return!0});c(c$,"isLastModel",function(a){return 0<this.desiredModelNumber||a>=this.lastModelNumber},"~N");c(c$,"appendLoadNote",function(a){null==a?this.loadNote=new JU.SB:(this.loadNote.append(a).append("\n"),JU.Logger.info(a))},
"~S");c(c$,"initializeTrajectoryFile",function(){this.asc.addAtom(new J.adapter.smarter.Atom);this.trajectorySteps=this.htParams.get("trajectorySteps");null==this.trajectorySteps&&this.htParams.put("trajectorySteps",this.trajectorySteps=new JU.Lst)});c(c$,"finalizeSubclassReader",function(){});c(c$,"finalizeReaderASCR",function(){this.isFinalized=!0;if(0<this.asc.atomSetCount){1==this.asc.atomSetCount&&(this.asc.setCurrentModelInfo("dbName",this.htParams.get("dbName")),this.asc.setCurrentModelInfo("auxFiles",
this.htParams.get("auxFiles")));this.applySymmetryAndSetTrajectory();this.asc.finalizeStructures();this.doCentralize&&this.asc.centralize();null!=this.fillRange&&this.asc.setInfo("boundbox",this.fillRange);var a=this.asc.getAtomSetAuxiliaryInfo(0);if(null!=a){if(null!=this.domains){this.asc.setGlobalBoolean(5);var b=this.domains.getMapKeys(2,!0),d=b.indexOf("{ ",2);0<=d&&(b=b.substring(d+2));d=b.indexOf("_metadata");0>d&&(d=b.indexOf("metadata"));0<=d&&(b=b.substring(0,d));b=JU.PT.rep(JU.PT.replaceAllCharacters(b,
"{}","").trim(),"\n","\n  ")+"\n\nUse SHOW DOMAINS for details.";this.appendLoadNote("\nDomains loaded:\n   "+b);for(b=this.asc.atomSetCount;0<=--b;)a=this.asc.getAtomSetAuxiliaryInfo(b),a.put("domains",this.domains)}if(null!=this.validation)for(b=this.asc.atomSetCount;0<=--b;)a=this.asc.getAtomSetAuxiliaryInfo(b),a.put("validation",this.validation);if(null!=this.dssr){a.put("dssrJSON",Boolean.TRUE);for(b=this.asc.atomSetCount;0<=--b;)a=this.asc.getAtomSetAuxiliaryInfo(b),a.put("dssr",this.dssr)}}}this.fixJavaFloat||
this.asc.setInfo("legacyJavaFloat",Boolean.TRUE);this.setLoadNote()});c(c$,"setLoadNote",function(){var a=this.loadNote.toString();0<this.loadNote.length()&&this.asc.setInfo("modelLoadNote",a);return a});c(c$,"setIsPDB",function(){this.asc.setGlobalBoolean(4);null!=this.htParams.get("pdbNoHydrogens")&&this.asc.setInfo("pdbNoHydrogens",this.htParams.get("pdbNoHydrogens"));this.checkFilterKey("ADDHYDROGENS")&&this.asc.setInfo("pdbAddHydrogens",Boolean.TRUE)});c(c$,"setModelPDB",function(a){a?this.asc.setGlobalBoolean(4):
this.asc.clearGlobalBoolean(4);this.asc.setCurrentModelInfo("isPDB",a?Boolean.TRUE:null)},"~B");c(c$,"finish",function(){var a=this.htParams.get("loadState");this.asc.setInfo("loadState",null==a?"":a);a=this.htParams.get("smilesString");null!=a&&this.asc.setInfo("smilesString",a);this.htParams.containsKey("templateAtomCount")||this.htParams.put("templateAtomCount",Integer.$valueOf(this.asc.ac));null!=this.bsFilter&&(this.htParams.put("filteredAtomCount",Integer.$valueOf(JU.BSUtil.cardinalityOf(this.bsFilter))),
this.htParams.put("bsFilter",this.bsFilter));this.calculationType.equals("?")||this.asc.setInfo("calculationType",this.calculationType);var b=a=this.asc.fileTypeName;0<=b.indexOf("(")&&(b=b.substring(0,b.indexOf("(")));for(var d=this.asc.atomSetCount;0<=--d;)this.asc.setModelInfoForSet("fileName",this.filePath,d),this.asc.setModelInfoForSet("fileType",b,d);this.asc.freeze(this.reverseModels);if(null!=this.asc.errorMessage)return this.asc.errorMessage+"\nfor file "+this.filePath+"\ntype "+a;if((null==
this.asc.bsAtoms?0==this.asc.ac:0>this.asc.bsAtoms.nextSetBit(0))&&0>b.indexOf("DataOnly")&&null==this.asc.atomSetInfo.get("dataOnly"))return"No atoms found\nfor file "+this.filePath+"\ntype "+a;this.fixBaseIndices();return this.asc});c(c$,"setError",function(a){var b=a.getMessage();this.asc.errorMessage=null==this.line?"Error reading file at end of file \n"+b:"Error reading file at line "+this.ptLine+":\n"+this.line+"\n"+b;a.printStackTrace()},"Throwable");c(c$,"initialize",function(){this.htParams.containsKey("baseAtomIndex")&&
(this.baseAtomIndex=this.htParams.get("baseAtomIndex").intValue());this.htParams.containsKey("baseBondIndex")&&(this.baseBondIndex=this.htParams.get("baseBondIndex").intValue());this.initializeSymmetry();this.vwr=this.htParams.remove("vwr");this.htParams.containsKey("stateScriptVersionInt")&&(this.stateScriptVersionInt=this.htParams.get("stateScriptVersionInt").intValue());var a=this.htParams.get("packingError");null!=a?this.packingError=a.floatValue():null!=this.htParams.get("legacyJavaFloat")&&
(this.fixJavaFloat=!1);this.merging=this.htParams.containsKey("merging");this.getHeader=this.htParams.containsKey("getHeader");this.isSequential=this.htParams.containsKey("isSequential");this.readerName=this.htParams.get("readerName");this.htParams.containsKey("outputChannel")&&(this.out=this.htParams.get("outputChannel"));this.htParams.containsKey("vibrationNumber")?this.desiredVibrationNumber=this.htParams.get("vibrationNumber").intValue():this.htParams.containsKey("modelNumber")&&(this.desiredModelNumber=
this.htParams.get("modelNumber").intValue());this.applySymmetryToBonds=this.htParams.containsKey("applySymmetryToBonds");this.bsFilter=this.requiresBSFilter?this.htParams.get("bsFilter"):null;this.setFilter(null);this.fillRange=this.htParams.get("fillRange");null!=this.strSupercell&&!this.checkFilterKey("NOPACK")&&(this.forcePacked=!0);a=this.htParams.get("supercell");n(a,JU.P3)?(a=this.ptSupercell=a,this.strSupercell=A(a.x)+"a,"+A(a.y)+"b,"+A(a.z)+"c"):n(a,String)&&(this.strSupercell=a);a=this.htParams.containsKey("ptFile")?
this.htParams.get("ptFile").intValue():-1;this.isTrajectory=this.htParams.containsKey("isTrajectory");0<a&&this.htParams.containsKey("firstLastSteps")?(a=this.htParams.get("firstLastSteps").get(a-1),n(a,JU.BS)?this.bsModels=a:this.firstLastStep=a):this.htParams.containsKey("firstLastStep")?this.firstLastStep=this.htParams.get("firstLastStep"):this.htParams.containsKey("bsModels")&&(this.bsModels=this.htParams.get("bsModels"));this.useFileModelNumbers=this.htParams.containsKey("useFileModelNumbers")||
this.checkFilterKey("USEFILEMODELNUMBERS");this.htParams.containsKey("templateAtomCount")&&(this.templateAtomCount=this.htParams.get("templateAtomCount").intValue());if(null!=this.bsModels||null!=this.firstLastStep)this.desiredModelNumber=-2147483648;if(null==this.bsModels&&null!=this.firstLastStep){0>this.firstLastStep[0]&&(this.firstLastStep[0]=0);if(0==this.firstLastStep[2]||this.firstLastStep[1]<this.firstLastStep[0])this.firstLastStep[1]=-1;1>this.firstLastStep[2]&&(this.firstLastStep[2]=1);
this.bsModels=JU.BSUtil.newAndSetBit(this.firstLastStep[0]);if(this.firstLastStep[1]>this.firstLastStep[0])for(a=this.firstLastStep[0];a<=this.firstLastStep[1];a+=this.firstLastStep[2])this.bsModels.set(a)}if(null!=this.bsModels&&(null==this.firstLastStep||-1!=this.firstLastStep[1]))this.lastModelNumber=this.bsModels.length();this.symmetryRange=this.htParams.containsKey("symmetryRange")?this.htParams.get("symmetryRange").floatValue():0;this.paramsLattice=this.htParams.get("lattice");this.paramsCentroid=
this.htParams.containsKey("centroid");this.paramsPacked=this.htParams.containsKey("packed");this.initializeSymmetryOptions();this.htParams.containsKey("spaceGroupIndex")&&(this.desiredSpaceGroupIndex=this.htParams.get("spaceGroupIndex").intValue(),-2==this.desiredSpaceGroupIndex&&(this.sgName=this.htParams.get("spaceGroupName")),this.ignoreFileSpaceGroupName=-2==this.desiredSpaceGroupIndex||0<=this.desiredSpaceGroupIndex,this.ignoreFileSymmetryOperators=-1!=this.desiredSpaceGroupIndex);this.htParams.containsKey("unitCellOffset")&&
(this.fileScaling=JU.P3.new3(1,1,1),this.fileOffset=this.htParams.get("unitCellOffset"),this.fileOffsetFractional=JU.P3.newP(this.fileOffset),this.unitCellOffsetFractional=this.htParams.containsKey("unitCellOffsetFractional"));this.htParams.containsKey("unitcell")&&(a=this.htParams.get("unitcell"),this.merging&&this.setFractionalCoordinates(!0),9==a.length?(this.addExplicitLatticeVector(0,a,0),this.addExplicitLatticeVector(1,a,3),this.addExplicitLatticeVector(2,a,6)):this.setUnitCell(a[0],a[1],a[2],
a[3],a[4],a[5]),this.ignoreFileUnitCell=this.iHaveUnitCell,this.merging&&!this.iHaveUnitCell&&this.setFractionalCoordinates(!1));this.domains=this.htParams.get("domains");this.validation=this.htParams.get("validation");this.dssr=this.htParams.get("dssr");this.isConcatenated=this.htParams.containsKey("concatenate")});c(c$,"initializeSymmetryOptions",function(){this.latticeCells=B(4,0);this.doApplySymmetry=!1;var a=this.paramsLattice;if(null==a||0==a.length()){if(!this.forcePacked&&null==this.strSupercell)return;
a=JU.P3.new3(1,1,1)}this.latticeCells[0]=A(a.x);this.latticeCells[1]=A(a.y);this.latticeCells[2]=A(a.z);n(a,JU.T4)&&(this.latticeCells[3]=A(a.w));if((this.doCentroidUnitCell=this.paramsCentroid)&&(-1==this.latticeCells[2]||0==this.latticeCells[2]))this.latticeCells[2]=1;a=this.forcePacked||this.paramsPacked;this.centroidPacked=this.doCentroidUnitCell&&a;this.doPackUnitCell=!this.doCentroidUnitCell&&(a||0>this.latticeCells[2]);this.doApplySymmetry=0<this.latticeCells[0]&&0<this.latticeCells[1];this.doApplySymmetry||
(this.latticeCells=B(3,0))});c(c$,"doGetModel",function(a,b){if(null!=b&&null!=this.nameRequired&&0<this.nameRequired.length&&0>b.toUpperCase().indexOf(this.nameRequired))return!1;var d=null==this.bsModels?1>this.desiredModelNumber||a==this.desiredModelNumber:a>this.lastModelNumber?!1:0<a&&this.bsModels.get(a-1)||this.haveModel&&null!=this.firstLastStep&&0>this.firstLastStep[1]&&(2>this.firstLastStep[2]||0==(a-1-this.firstLastStep[0])%this.firstLastStep[2]);d&&0==this.desiredModelNumber&&this.discardPreviousAtoms();
this.haveModel=(new Boolean(this.haveModel|d)).valueOf();d&&(this.doProcessLines=!0);return d},"~N,~S");c(c$,"discardPreviousAtoms",function(){this.asc.discardPreviousAtoms()});c(c$,"initializeSymmetry",function(){this.previousSpaceGroup=this.sgName;this.previousUnitCell=this.unitCellParams;this.iHaveUnitCell=this.ignoreFileUnitCell;if(!this.ignoreFileUnitCell){this.unitCellParams=K(26,0);for(var a=25;0<=--a;)this.unitCellParams[a]=NaN;this.unitCellParams[25]=this.latticeScaling;this.symmetry=null}this.ignoreFileSpaceGroupName||
(this.sgName="unspecified!");this.doCheckUnitCell=!1});c(c$,"newAtomSet",function(a){0<=this.asc.iSet?(this.asc.newAtomSet(),this.asc.setCollectionName("<collection of "+(this.asc.iSet+1)+" models>")):this.asc.setCollectionName(a);this.asc.setModelInfoForSet("name",a,Math.max(0,this.asc.iSet));this.asc.setAtomSetName(a)},"~S");c(c$,"cloneLastAtomSet",function(a,b){var d=this.asc.getLastAtomSetAtomCount();this.asc.cloneLastAtomSetFromPoints(a,b);this.asc.haveUnitCell&&(this.doCheckUnitCell=this.iHaveUnitCell=
!0,this.sgName=this.previousSpaceGroup,this.unitCellParams=this.previousUnitCell);return d},"~N,~A");c(c$,"setSpaceGroupName",function(a){this.ignoreFileSpaceGroupName||null==a||(a=a.trim(),0==a.length||(a.equals("HM:")||a.equals(this.sgName))||(a.equals("P1")||JU.Logger.info("Setting space group name to "+a),this.sgName=a))},"~S");c(c$,"setSymmetryOperator",function(a){if(this.ignoreFileSymmetryOperators)return-1;var b=this.asc.getXSymmetry().addSpaceGroupOperation(a,!0);0>b&&JU.Logger.warn("Skippings symmetry operation "+
a);this.iHaveSymmetryOperators=!0;return b},"~S");c(c$,"initializeCartesianToFractional",function(){for(var a=0;16>a;a++)if(!Float.isNaN(this.unitCellParams[6+a]))return;for(a=0;16>a;a++)this.unitCellParams[6+a]=0==a%5?1:0;this.nMatrixElements=0});c(c$,"clearUnitCell",function(){if(!this.ignoreFileUnitCell){for(var a=6;22>a;a++)this.unitCellParams[a]=NaN;this.checkUnitCell(6)}});c(c$,"setUnitCellItem",function(a,b){this.ignoreFileUnitCell||(0==a&&1==b&&!this.allow_a_len_1||3==a&&0==b?(null==this.ucItems&&
(this.ucItems=K(6,0)),this.ucItems[a]=b):(null!=this.ucItems&&6>a&&(this.ucItems[a]=b),!Float.isNaN(b)&&(6<=a&&Float.isNaN(this.unitCellParams[6]))&&this.initializeCartesianToFractional(),this.unitCellParams[a]=b,this.debugging&&JU.Logger.debug("setunitcellitem "+a+" "+b),6>a||Float.isNaN(b)?this.iHaveUnitCell=this.checkUnitCell(6):12==++this.nMatrixElements&&(this.iHaveUnitCell=this.checkUnitCell(22))))},"~N,~N");c(c$,"setUnitCell",function(a,b,d,g,c,e){this.ignoreFileUnitCell||(this.clearUnitCell(),
this.unitCellParams[0]=a,this.unitCellParams[1]=b,this.unitCellParams[2]=d,0!=g&&(this.unitCellParams[3]=g),0!=c&&(this.unitCellParams[4]=c),0!=e&&(this.unitCellParams[5]=e),this.iHaveUnitCell=this.checkUnitCell(6))},"~N,~N,~N,~N,~N,~N");c(c$,"addExplicitLatticeVector",function(a,b,d){if(!this.ignoreFileUnitCell){if(0==a)for(var g=0;6>g;g++)this.unitCellParams[g]=0;a=6+3*a;this.unitCellParams[a++]=b[d++];this.unitCellParams[a++]=b[d++];this.unitCellParams[a]=b[d];if(Float.isNaN(this.unitCellParams[0]))for(a=
0;6>a;a++)this.unitCellParams[a]=-1;this.iHaveUnitCell=this.checkUnitCell(15)}},"~N,~A,~N");c(c$,"checkUnitCell",function(a){for(var b=0;b<a;b++)if(Float.isNaN(this.unitCellParams[b]))return!1;if(22==a&&1==this.unitCellParams[0]&&1==this.unitCellParams[1]&&1==this.unitCellParams[2]&&1==this.unitCellParams[6]&&1==this.unitCellParams[11]&&1==this.unitCellParams[16])return!1;this.doApplySymmetry&&(this.getSymmetry(),this.doConvertToFractional=!this.fileCoordinatesAreFractional);return!0},"~N");c(c$,
"getSymmetry",function(){if(!this.iHaveUnitCell)return null;null==this.symmetry&&(this.getNewSymmetry().setUnitCell(this.unitCellParams,!1),this.checkUnitCellOffset());null==this.symmetry?this.iHaveUnitCell=!1:this.symmetry.setSpaceGroupName(this.sgName);return this.symmetry});c(c$,"checkUnitCellOffset",function(){null==this.fileOffsetFractional||null==this.symmetry||(this.fileOffset.setT(this.fileOffsetFractional),this.unitCellOffsetFractional!=this.fileCoordinatesAreFractional&&(this.unitCellOffsetFractional?
this.symmetry.toCartesian(this.fileOffset,!1):this.symmetry.toFractional(this.fileOffset,!1)))});c(c$,"fractionalizeCoordinates",function(a){if(null!=this.getSymmetry()){var b=this.asc.atoms;if(a)for(var d=this.asc.ac;0<=--d;)this.symmetry.toFractional(b[d],!1);else for(d=this.asc.ac;0<=--d;)this.symmetry.toCartesian(b[d],!1);this.setFractionalCoordinates(a)}},"~B");c(c$,"getNewSymmetry",function(){return this.symmetry=this.getInterface("JS.Symmetry")});c(c$,"setFractionalCoordinates",function(a){this.iHaveFractionalCoordinates=
this.fileCoordinatesAreFractional=a;this.checkUnitCellOffset()},"~B");c(c$,"setFilterAtomTypeStr",function(a){this.filterAtomTypeStr=a;this.filterAtomNameTerminator="\x00"},"~S");c(c$,"setFilter",function(a){null==a?a=this.htParams.get("filter"):this.bsFilter=null;null!=a&&(a=a.toUpperCase());this.filter=a;this.doSetOrientation=!this.checkFilterKey("NOORIENT");this.doCentralize=!this.checkFilterKey("NOCENTER")&&this.checkFilterKey("CENTER");this.addVibrations=!this.checkFilterKey("NOVIB");this.ignoreStructure=
this.checkFilterKey("DSSP");this.isDSSP1=this.checkFilterKey("DSSP1");this.doReadMolecularOrbitals=!this.checkFilterKey("NOMO");this.useAltNames=this.checkFilterKey("ALTNAME");this.reverseModels=this.checkFilterKey("REVERSEMODELS");this.allow_a_len_1=this.checkFilterKey("TOPOS");if(null!=this.filter){this.checkFilterKey("HETATM")&&(this.filterHetero=!0,this.filter=JU.PT.rep(this.filter,"HETATM","HETATM-Y"));this.checkFilterKey("ATOM")&&(this.filterHetero=!0,this.filter=JU.PT.rep(this.filter,"ATOM",
"HETATM-N"));this.checkFilterKey("CELL=")&&(this.strSupercell=this.filter.substring(this.filter.indexOf("CELL=")+5).toLowerCase());this.nameRequired=JU.PT.getQuotedAttribute(this.filter,"NAME");null!=this.nameRequired&&(this.nameRequired.startsWith("'")?this.nameRequired=JU.PT.split(this.nameRequired,"'")[1]:this.nameRequired.startsWith('"')&&(this.nameRequired=JU.PT.split(this.nameRequired,'"')[1]),this.filter=JU.PT.rep(this.filter,this.nameRequired,""),this.filter=JU.PT.rep(this.filter,"NAME=",
""));this.filterAtomName=this.checkFilterKey("*.")||this.checkFilterKey("!.");if(this.filter.startsWith("_")||0<=this.filter.indexOf(";_"))this.filterElement=this.checkFilterKey("_");this.filterGroup3=this.checkFilterKey("[");this.filterChain=this.checkFilterKey(":");this.filterAltLoc=this.checkFilterKey("%");if(this.filterEveryNth=this.checkFilterKey("/="))this.filterN=this.parseIntAt(this.filter,this.filter.indexOf("/=")+2);else if(this.filter.startsWith("=")||0<=this.filter.indexOf(";="))this.filterAtomType=
this.checkFilterKey("=");-2147483648==this.filterN&&(this.filterEveryNth=!1);this.haveAtomFilter=this.filterAtomName||this.filterAtomType||this.filterElement||this.filterGroup3||this.filterChain||this.filterAltLoc||this.filterHetero||this.filterEveryNth||this.checkFilterKey("/=");if(null==this.bsFilter&&(this.bsFilter=new JU.BS,this.htParams.put("bsFilter",this.bsFilter),this.filter=(";"+this.filter+";").$replace(",",";"),a=this.getFilter("LATTICESCALING="),null!=a&&25<this.unitCellParams.length&&
(this.unitCellParams[25]=this.latticeScaling=this.parseFloatStr(a)),a=this.getFilter("SYMOP="),null!=a&&(this.filterSymop=" "+a+" "),JU.Logger.info("filtering with "+this.filter),this.haveAtomFilter&&(this.filter1=this.filter,0<=(a=this.filter.indexOf("|")))))this.filter1=this.filter.substring(0,a).trim()+";",this.filter2=";"+this.filter.substring(a).trim()}},"~S");c(c$,"getFilter",function(a){var b=null==this.filter?-1:this.filter.indexOf(a);return 0>b?null:this.filter.substring(b+a.length,this.filter.indexOf(";",
b))},"~S");c(c$,"checkFilterKey",function(a){return null!=this.filter&&0<=this.filter.indexOf(a)},"~S");c(c$,"checkAndRemoveFilterKey",function(a){if(!this.checkFilterKey(a))return!1;this.filter=JU.PT.rep(this.filter,a,"");3>this.filter.length&&(this.filter=null);return!0},"~S");c(c$,"filterAtom",function(a,b){if(!this.haveAtomFilter)return!0;var d=this.checkFilter(a,this.filter1);null!=this.filter2&&(d=(new Boolean(d|this.checkFilter(a,this.filter2))).valueOf());d&&this.filterEveryNth&&(d=0==this.nFiltered++%
this.filterN);this.bsFilter.setBitTo(0<=b?b:this.asc.ac,d);return d},"J.adapter.smarter.Atom,~N");c(c$,"checkFilter",function(a,b){return(!this.filterGroup3||null==a.group3||!this.filterReject(b,"[",a.group3.toUpperCase()+"]"))&&(!this.filterAtomName||this.allowAtomName(a.atomName,b))&&(null==this.filterAtomTypeStr||null==a.atomName||0<=a.atomName.toUpperCase().indexOf("\x00"+this.filterAtomTypeStr))&&(!this.filterElement||null==a.elementSymbol||!this.filterReject(b,"_",a.elementSymbol.toUpperCase()+
";"))&&(!this.filterChain||0==a.chainID||!this.filterReject(b,":",""+this.vwr.getChainIDStr(a.chainID)))&&(!this.filterAltLoc||"\x00"==a.altLoc||!this.filterReject(b,"%",""+a.altLoc))&&(!this.filterHetero||!this.allowPDBFilter||!this.filterReject(b,"HETATM",a.isHetero?"-Y":"-N"))},"J.adapter.smarter.Atom,~S");c(c$,"rejectAtomName",function(a){return this.filterAtomName&&!this.allowAtomName(a,this.filter)},"~S");c(c$,"allowAtomName",function(a,b){return null==a||!this.filterReject(b,".",a.toUpperCase()+
this.filterAtomNameTerminator)},"~S,~S");c(c$,"filterReject",function(a,b,d){return 0<=a.indexOf(b)&&0<=a.indexOf("!"+b)==0<=a.indexOf(b+d)},"~S,~S,~S");c(c$,"set2D",function(){this.asc.setInfo("is2D",Boolean.TRUE);this.checkFilterKey("NOMIN")||this.asc.setInfo("doMinimize",Boolean.TRUE);this.appendLoadNote("This model is 2D. Its 3D structure will be generated.")});c(c$,"doGetVibration",function(a){return this.addVibrations&&(0>=this.desiredVibrationNumber||a==this.desiredVibrationNumber)},"~N");
c(c$,"setTransform",function(a,b,d,g,c,e,h,k,l){null==this.matRot&&this.doSetOrientation&&(this.matRot=new JU.M3,a=JU.V3.new3(a,b,d),a.normalize(),this.matRot.setColumnV(0,a),a.set(g,c,e),a.normalize(),this.matRot.setColumnV(1,a),a.set(h,k,l),a.normalize(),this.matRot.setColumnV(2,a),this.asc.setInfo("defaultOrientationMatrix",JU.M3.newM3(this.matRot)),g=JU.Quat.newM(this.matRot),this.asc.setInfo("defaultOrientationQuaternion",g),JU.Logger.info("defaultOrientationMatrix = "+this.matRot))},"~N,~N,~N,~N,~N,~N,~N,~N,~N");
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this.xEndcap-C,this.yEndcap-r,this.zEndcap+n-1,a,b,j))),this.line3d.plotLineDeltaAOld(this.shadesA,this.shadesB,d,y,this.xA+C,this.yA+r,this.zA-n,this.dxB,this.dyB,this.dzB,this.clipped),l&&this.line3d.plotLineDeltaOld(this.shadesA[F],this.shadesB[F],this.xA-C,this.yA-r,this.zA+n,this.dxB,this.dyB,this.dzB,this.clipped);x.setZMargin(0);3==g&&this.renderSphericalEndcaps()}},"~N,~N,~N,~N,~N,~N,~N,~N,~N,~N,~N");c(c$,"renderBitsFloat",function(a,b,d,g,c,e,h){var k=this.g3d;null==this.ptA0&&(this.ptA0=
new JU.P3,this.ptB0=new JU.P3);this.ptA0.setT(e);var l=w(c/2)+1,j=Math.round(e.x),m=Math.round(e.y),r=Math.round(e.z),x=Math.round(h.x),y=Math.round(h.y),F=Math.round(h.z),C=k.clipCode3(j-l,m-l,r-l),j=k.clipCode3(j+l,m+l,r+l),m=k.clipCode3(x-l,y-l,F-l),l=k.clipCode3(x+l,y+l,F+l),x=C|j|m|l;this.clipped=0!=x;if(!(-1==x||0!=(C&l&j&m))){this.dxBf=h.x-e.x;this.dyBf=h.y-e.y;this.dzBf=h.z-e.z;0<c&&(this.diameter=c,this.xAf=e.x,this.yAf=e.y,this.zAf=e.z);e=0==d&&(this.clipped||2==g||0==g);this.xA=A(this.xAf);
this.yA=A(this.yAf);this.zA=A(this.zAf);this.dxB=A(this.dxBf);this.dyB=A(this.dyBf);this.dzB=A(this.dzBf);this.shadesA=k.getShades(this.colixA=a);this.shadesB=k.getShades(this.colixB=b);this.endcaps=g;this.calcArgbEndcap(!0,!0);x=this.xyzfRaster;0<c&&this.generateBaseEllipsePrecisely(!1);2==g&&this.renderFlatEndcap(!0,!0,x);this.line3d.setLineBits(this.dxBf,this.dyBf);k.setZMargin(5);c=k.pixel;a=k.width;b=k.zbuf;h=x[0];C=x[1];l=x[2];x=x[3];for(y=this.rasterCount;0<=--y;){var F=x[y]>>8,j=F>>1,m=h[y],
r=C[y],n=l[y];this.endCapHidden&&0!=this.argbEndcap&&(this.clipped?(k.plotPixelClippedArgb(this.argbEndcap,this.xEndcap+m,this.yEndcap+r,this.zEndcap-n-1,a,b,c),k.plotPixelClippedArgb(this.argbEndcap,this.xEndcap-m,this.yEndcap-r,this.zEndcap+n-1,a,b,c)):(k.plotPixelUnclipped(this.argbEndcap,this.xEndcap+m,this.yEndcap+r,this.zEndcap-n-1,a,b,c),k.plotPixelUnclipped(this.argbEndcap,this.xEndcap-m,this.yEndcap-r,this.zEndcap+n-1,a,b,c)));this.ptA0.set(this.xA+m,this.yA+r,this.zA-n);this.ptB0.setT(this.ptA0);
this.ptB0.x+=this.dxB;this.ptB0.y+=this.dyB;this.ptB0.z+=this.dzB;this.line3d.plotLineDeltaABitsFloat(this.shadesA,this.shadesB,F,this.ptA0,this.ptB0,d,this.clipped);e&&(this.ptA0.set(this.xA-m,this.yA-r,this.zA+n),this.ptB0.setT(this.ptA0),this.ptB0.x+=this.dxB,this.ptB0.y+=this.dyB,this.ptB0.z+=this.dzB,this.line3d.plotLineDeltaABitsFloat(this.shadesA,this.shadesB,j,this.ptA0,this.ptB0,d,this.clipped))}k.setZMargin(0);3==g&&this.renderSphericalEndcaps();this.xAf+=this.dxBf;this.yAf+=this.dyBf;this.zAf+=
this.dzBf}},"~N,~N,~N,~N,~N,JU.P3,JU.P3");c(c$,"renderBits",function(a,b,d,g,c,e,h){var k=this.g3d;if(0==c||1==c)this.line3d.plotLineBits(k.getColorArgbOrGray(a),k.getColorArgbOrGray(b),e,h,0,0,!1);else{this.ptA0i.setT(e);var l=w(c/2)+1,j=e.x,m=e.y,r=e.z,x=h.x,y=h.y,F=h.z,C=k.clipCode3(j-l,m-l,r-l),j=k.clipCode3(j+l,m+l,r+l),m=k.clipCode3(x-l,y-l,F-l),l=k.clipCode3(x+l,y+l,F+l),x=C|j|m|l;this.clipped=0!=x;if(!(-1==x||0!=(C&l&j&m))){this.dxBf=h.x-e.x;this.dyBf=h.y-e.y;this.dzBf=h.z-e.z;0<c&&(this.diameter=
c,this.xAf=e.x,this.yAf=e.y,this.zAf=e.z);e=0==d&&(this.clipped||2==g||0==g);this.xA=A(this.xAf);this.yA=A(this.yAf);this.zA=A(this.zAf);this.dxB=A(this.dxBf);this.dyB=A(this.dyBf);this.dzB=A(this.dzBf);this.shadesA=k.getShades(this.colixA=a);this.shadesB=k.getShades(this.colixB=b);this.endcaps=g;this.calcArgbEndcap(!0,!0);x=this.xyzfRaster;0<c&&this.generateBaseEllipsePrecisely(!1);2==g&&this.renderFlatEndcap(!0,!0,x);this.line3d.setLineBits(this.dxBf,this.dyBf);k.setZMargin(5);c=k.pixel;a=k.width;
b=k.zbuf;h=x[0];C=x[1];l=x[2];x=x[3];for(y=this.rasterCount;0<=--y;){var F=x[y]>>8,j=F>>1,m=h[y],r=C[y],n=l[y];this.endCapHidden&&0!=this.argbEndcap&&(this.clipped?(k.plotPixelClippedArgb(this.argbEndcap,this.xEndcap+m,this.yEndcap+r,this.zEndcap-n-1,a,b,c),k.plotPixelClippedArgb(this.argbEndcap,this.xEndcap-m,this.yEndcap-r,this.zEndcap+n-1,a,b,c)):(k.plotPixelUnclipped(this.argbEndcap,this.xEndcap+m,this.yEndcap+r,this.zEndcap-n-1,a,b,c),k.plotPixelUnclipped(this.argbEndcap,this.xEndcap-m,this.yEndcap-
r,this.zEndcap+n-1,a,b,c)));this.ptA0i.set(this.xA+m,this.yA+r,this.zA-n);this.ptB0i.setT(this.ptA0i);this.ptB0i.x+=this.dxB;this.ptB0i.y+=this.dyB;this.ptB0i.z+=this.dzB;this.line3d.plotLineDeltaABitsInt(this.shadesA,this.shadesB,F,this.ptA0i,this.ptB0i,d,this.clipped);e&&(this.ptA0i.set(this.xA-m,this.yA-r,this.zA+n),this.ptB0i.setT(this.ptA0i),this.ptB0i.x+=this.dxB,this.ptB0i.y+=this.dyB,this.ptB0i.z+=this.dzB,this.line3d.plotLineDeltaABitsInt(this.shadesA,this.shadesB,j,this.ptA0i,this.ptB0i,
d,this.clipped))}k.setZMargin(0);3==g&&this.renderSphericalEndcaps();this.xAf+=this.dxBf;this.yAf+=this.dyBf;this.zAf+=this.dzBf}}},"~N,~N,~N,~N,~N,JU.P3i,JU.P3i");c(c$,"renderConeOld",function(a,b,d,g,c,e,h,k,l,j,m){this.dxBf=h-(this.xAf=g);this.dyBf=k-(this.yAf=c);this.dzBf=l-(this.zAf=e);this.xA=w(Math.floor(this.xAf));this.yA=w(Math.floor(this.yAf));this.zA=w(Math.floor(this.zAf));this.dxB=w(Math.floor(this.dxBf));this.dyB=w(Math.floor(this.dyBf));this.dzB=w(Math.floor(this.dzBf));this.xTip=h;
this.yTip=k;this.zTip=l;this.shadesA=this.g3d.getShades(this.colixA=a);var r=this.shader.getShadeIndex(this.dxB,this.dyB,-this.dzB);a=this.g3d;g=a.pixel;c=a.width;e=a.zbuf;a.plotPixelClippedArgb(this.shadesA[r],A(h),A(k),A(l),c,e,g);this.diameter=d;if(1>=d)1==d&&this.line3d.plotLineDeltaOld(this.colixA,this.colixA,this.xA,this.yA,this.zA,this.dxB,this.dyB,this.dzB,this.clipped);else{this.endcaps=b;this.calcArgbEndcap(!1,!0);this.generateBaseEllipsePrecisely(m);!m&&2==this.endcaps&&this.renderFlatEndcap(!1,
!0,this.xyzfRaster);a.setZMargin(5);b=this.xyztRaster[0];d=this.xyztRaster[1];h=this.xyztRaster[2];k=this.xyzfRaster[3];l=this.shadesA;for(var r=this.endCapHidden&&0!=this.argbEndcap,x=this.rasterCount;0<=--x;){var y=b[x],F=d[x],C=h[x],n=k[x]>>8,p=this.xAf+y,q=this.yAf+F,s=this.zAf-C,y=this.xAf-y,F=this.yAf-F,C=this.zAf+C,t=l[0];r&&(a.plotPixelClippedArgb(this.argbEndcap,A(p),A(q),A(s),c,e,g),a.plotPixelClippedArgb(this.argbEndcap,A(y),A(F),A(C),c,e,g));0!=t&&(this.line3d.plotLineDeltaAOld(l,l,0,
n,A(p),A(q),A(s),w(Math.ceil(this.xTip-p)),w(Math.ceil(this.yTip-q)),w(Math.ceil(this.zTip-s)),!0),j&&(this.line3d.plotLineDeltaAOld(l,l,0,n,A(p),A(q)+1,A(s),w(Math.ceil(this.xTip-p)),w(Math.ceil(this.yTip-q))+1,w(Math.ceil(this.zTip-s)),!0),this.line3d.plotLineDeltaAOld(l,l,0,n,A(p)+1,A(q),A(s),w(Math.ceil(this.xTip-p))+1,w(Math.ceil(this.yTip-q)),w(Math.ceil(this.zTip-s)),!0)),!m&&!(2!=this.endcaps&&0<this.dzB)&&this.line3d.plotLineDeltaOld(t,t,A(y),A(F),A(C),w(Math.ceil(this.xTip-y)),w(Math.ceil(this.yTip-
F)),w(Math.ceil(this.zTip-C)),!0))}a.setZMargin(0)}},"~N,~N,~N,~N,~N,~N,~N,~N,~N,~B,~B");c(c$,"generateBaseEllipsePrecisely",function(a){this.calcCosSin(this.dxBf,this.dyBf,this.dzBf);this.calcPoints(a?2:3,!0);this.interpolatePrecisely(0,1,this.xyzfRaster,this.xyztRaster);a||this.interpolatePrecisely(1,2,this.xyzfRaster,this.xyztRaster);for(a=3;0<=--a;)for(var b=this.rasterCount;0<=--b;)this.xyzfRaster[a][b]=w(Math.floor(this.xyztRaster[a][b]))},"~B");c(c$,"calcPoints",function(a,b){this.calcRotatedPoint(0,
0,b,this.xyzfRaster,this.xyztRaster);this.calcRotatedPoint(0.5,1,b,this.xyzfRaster,this.xyztRaster);3==(this.rasterCount=a)&&this.calcRotatedPoint(1,2,b,this.xyzfRaster,this.xyztRaster)},"~N,~B");c(c$,"calcCosSin",function(a,b,d){var g=a*a+b*b;if(0==g)this.cosPhi=this.cosTheta=1,this.sinPhi=0;else{var c=Math.sqrt(g),g=Math.sqrt(g+d*d);this.cosTheta=d/g;this.cosPhi=a/c;this.sinPhi=b/c}},"~N,~N,~N");c(c$,"calcRotatedPoint",function(a,b,d,g,c){c[3][b]=a;a*=3.141592653589793;var e=Math.sin(a)*this.cosTheta,
h=Math.cos(a);a=this.radius*(e*this.cosPhi-h*this.sinPhi);e=this.radius*(e*this.sinPhi+h*this.cosPhi);h=this.radius2-(a*a+e*e);h=0<h?Math.sqrt(h):0;d?(c[0][b]=a,c[1][b]=e,c[2][b]=h):(this.tEvenDiameter?(g[0][b]=w(a-0.5),g[1][b]=w(e-0.5)):(g[0][b]=w(a),g[1][b]=w(e)),g[2][b]=w(h+0.5));g[3][b]=this.shader.getShadeFp8(a,e,h)},"~N,~N,~B,~A,~A");c(c$,"allocRaster",function(a,b,d){if(this.rasterCount>=b[0].length)for(;this.rasterCount>=b[0].length;){for(var g=4;0<=--g;)b[g]=JU.AU.doubleLengthI(b[g]);d[3]=
JU.AU.doubleLengthF(d[3])}if(a)for(;this.rasterCount>=d[0].length;)for(g=3;0<=--g;)d[g]=JU.AU.doubleLengthF(d[g]);return this.rasterCount++},"~B,~A,~A");c(c$,"interpolate",function(a,b,d,g){var c=d[0],e=d[1],c=c[b]-c[a];0>c&&(c=-c);e=e[b]-e[a];0>e&&(e=-e);if(!(1>=c+e)){for(var h=this.allocRaster(!1,d,g),c=d[0],e=d[1],k=d[3],l=g[3][a],j=g[3][b],m=4;0<=--m;){var r=(l+j)/2;this.calcRotatedPoint(r,h,!1,d,g);if(c[h]==c[a]&&e[h]==e[a])k[a]=k[a]+k[h]>>>1,l=r;else if(c[h]==c[b]&&e[h]==e[b])k[b]=k[b]+k[h]>>>
1,j=r;else{this.interpolate(a,h,d,g);this.interpolate(h,b,d,g);return}}c[h]=c[a];e[h]=e[b]}},"~N,~N,~A,~A");c(c$,"interpolatePrecisely",function(a,b,d,g){var c=g[0],e=g[1],h=w(Math.floor(c[b]))-w(Math.floor(c[a]));0>h&&(h=-h);e=w(Math.floor(e[b]))-w(Math.floor(e[a]));0>e&&(e=-e);if(!(1>=h+e)){for(var e=g[3],h=e[a],k=e[b],l=this.allocRaster(!0,d,g),c=g[0],e=g[1],j=d[3],m=4;0<=--m;){var r=(h+k)/2;this.calcRotatedPoint(r,l,!0,d,g);if(w(Math.floor(c[l]))==w(Math.floor(c[a]))&&w(Math.floor(e[l]))==w(Math.floor(e[a])))j[a]=
j[a]+j[l]>>>1,h=r;else if(w(Math.floor(c[l]))==w(Math.floor(c[b]))&&w(Math.floor(e[l]))==w(Math.floor(e[b])))j[b]=j[b]+j[l]>>>1,k=r;else{this.interpolatePrecisely(a,l,d,g);this.interpolatePrecisely(l,b,d,g);return}}c[l]=c[a];e[l]=e[b]}},"~N,~N,~A,~A");c(c$,"renderFlatEndcap",function(a,b,d){var g,c;if(b){if(0==this.dzBf||!this.g3d.setC(this.colixEndcap))return;b=this.xAf;g=this.yAf;c=this.zAf;a&&0>this.dzBf&&(b+=this.dxBf,g+=this.dyBf,c+=this.dzBf);b=A(b);g=A(g);c=A(c)}else{if(0==this.dzB||!this.g3d.setC(this.colixEndcap))return;
b=this.xA;g=this.yA;c=this.zA;a&&0>this.dzB&&(b+=this.dxB,g+=this.dyB,c+=this.dzB)}var e=d[1][0];a=d[1][0];var h=0,k=0,l=d[0],j=d[1];d=d[2];for(var m=this.rasterCount;0<--m;){var r=j[m];r<e?e=r:r>a?a=r:(r=-r,r<e?e=r:r>a&&(a=r))}for(r=e;r<=a;++r){for(var e=2147483647,x=-2147483648,m=this.rasterCount;0<=--m;){if(j[m]==r){var y=l[m];y<e&&(e=y,h=d[m]);y>x&&(x=y,k=d[m])}j[m]==-r&&(y=-l[m],y<e&&(e=y,h=-d[m]),y>x&&(x=y,k=-d[m]))}m=x-e+1;this.g3d.setColorNoisy(this.endcapShadeIndex);this.g3d.plotPixelsClippedRaster(m,
b+e,g+r,c-h-1,c-k-1,null,null)}},"~B,~B,~A");c(c$,"renderSphericalEndcaps",function(){0!=this.colixA&&this.g3d.setC(this.colixA)&&this.g3d.fillSphereXYZ(this.diameter,this.xA,this.yA,this.zA+1);0!=this.colixB&&this.g3d.setC(this.colixB)&&this.g3d.fillSphereXYZ(this.diameter,this.xA+this.dxB,this.yA+this.dyB,this.zA+this.dzB+1)});c(c$,"calcArgbEndcap",function(a,b){this.tEvenDiameter=0==(this.diameter&1);this.radius=this.diameter/2;this.radius2=this.radius*this.radius;this.endCapHidden=!1;var d=b?
this.dzBf:this.dzB;if(!(3==this.endcaps||0==d)){this.xEndcap=this.xA;this.yEndcap=this.yA;this.zEndcap=this.zA;var g=b?this.dxBf:this.dxB,c=b?this.dyBf:this.dyB;0<=d||!a?(this.endcapShadeIndex=this.shader.getShadeIndex(-g,-c,d),this.colixEndcap=this.colixA,d=this.shadesA):(this.endcapShadeIndex=this.shader.getShadeIndex(g,c,-d),this.colixEndcap=this.colixB,d=this.shadesB,this.xEndcap+=this.dxB,this.yEndcap+=this.dyB,this.zEndcap+=this.dzB);56<this.endcapShadeIndex&&(this.endcapShadeIndex=56);this.argbEndcap=
d[this.endcapShadeIndex];this.endCapHidden=1==this.endcaps}},"~B,~B")});s("J.g3d");N(J.g3d,"G3DRenderer");s("J.g3d");v(["J.api.JmolRendererInterface","JU.GData","JU.P3i","$.V3"],"J.g3d.Graphics3D","java.lang.NullPointerException java.util.Arrays JU.AU J.api.Interface J.c.STER J.g3d.CylinderRenderer $.LineRenderer $.Pixelator $.PixelatorScreened $.PixelatorShaded $.PixelatorT $.Platform3D $.SphereRenderer $.TextRenderer $.TextString JU.C $.Font $.Normix".split(" "),function(){c$=t(function(){this.hermite3d=
this.circle3d=this.triangle3d=this.cylinder3d=this.sphere3d=this.line3d=this.platform=null;this.antialias2=this.isFullSceneAntialiasingEnabled=!1;this.strings=null;this.stringCount=0;this.anaglyphChannelBytes=null;this.$haveTranslucentObjects=this.twoPass=!1;this.zbufT=this.zbuf=this.pbufT=this.pbuf=null;this.translucencyMask=0;this.renderLow=!1;this.shadesCurrent=null;this.anaglyphLength=0;this.pixelShaded=this.pixelScreened=this.pixelT0=this.pixel0=this.pixel=null;this.zMargin=0;this.aobuf=null;
this.translucencyLog=this.lastRawColor=this.currentShadeIndex=0;this.wasScreened=!1;this.saveDiffuse=this.saveAmbient=0;this.shadeIndexes2Sided=this.shadeIndexes=this.vectorNormal=this.vectorAC=this.vectorAB=this.sC=this.sB=this.sA=null;this.pass2Flag01=0;p(this,arguments)},J.g3d,"Graphics3D",JU.GData,J.api.JmolRendererInterface);O(c$,function(){this.sA=new JU.P3i;this.sB=new JU.P3i;this.sC=new JU.P3i;this.vectorAB=new JU.V3;this.vectorAC=new JU.V3;this.vectorNormal=new JU.V3;this.shadeIndexes=Q(JU.GData.normixCount,
0);this.shadeIndexes2Sided=Q(JU.GData.normixCount,0)});j(c$,"isWebGL",function(){return!1});j(c$,"clear",function(){this.stringCount=0;this.strings=null;J.g3d.TextRenderer.clearFontCache()});j(c$,"destroy",function(){this.releaseBuffers();this.graphicsForMetrics=this.pixelScreened=this.pixelT0=this.pixel=this.pixel0=this.pixelShaded=this.platform=null});c(c$,"setZMargin",function(a){this.zMargin=a},"~N");q(c$,function(){I(this,J.g3d.Graphics3D,[]);for(var a=JU.GData.normixCount;0<=--a;)this.transformedVectors[a]=
new JU.V3});j(c$,"initialize",function(a,b){this.vwr=a;this.apiPlatform=b;this.platform=new J.g3d.Platform3D(b);this.pixel=this.pixel0=new J.g3d.Pixelator(this);this.graphicsForMetrics=this.platform.getGraphicsForMetrics();this.line3d=new J.g3d.LineRenderer(this);this.sphere3d=new J.g3d.SphereRenderer(this);this.cylinder3d=new J.g3d.CylinderRenderer(this)},"JV.Viewer,J.api.GenericPlatform");j(c$,"addRenderer",function(a){switch(a){case 1073741880:null==this.circle3d&&(this.circle3d=this.getRenderer("Circle"));
break;case 553648145:null==this.hermite3d&&(this.hermite3d=this.getRenderer("Hermite"));case 1073742182:null==this.triangle3d&&(this.triangle3d=this.getRenderer("Triangle"),this.triangle3d.isOrthographic=!this.vwr.tm.perspectiveDepth)}},"~N");c(c$,"getRenderer",function(a){a=J.api.Interface.getOption("g3d."+a+"Renderer",this.vwr,"render");if(null==a)throw new NullPointerException("Interface");a.set(this,this);return a},"~S");j(c$,"setWindowParameters",function(a,b,d){this.setWinParams(a,b,d);this.currentlyRendering&&
this.endRendering()},"~N,~N,~B");j(c$,"checkTranslucent",function(a){a&&(this.$haveTranslucentObjects=!0);return!this.twoPass||this.twoPass&&this.isPass2==a},"~B");j(c$,"beginRendering",function(a,b,d,g){this.currentlyRendering&&this.endRendering();this.renderLow=g;if(this.windowWidth!=this.newWindowWidth||this.windowHeight!=this.newWindowHeight||this.newAntialiasing!=this.isFullSceneAntialiasingEnabled)this.windowWidth=this.newWindowWidth,this.windowHeight=this.newWindowHeight,this.isFullSceneAntialiasingEnabled=
this.newAntialiasing,this.releaseBuffers();this.setRotationMatrix(a);this.line3d.isOrthographic=!this.vwr.tm.perspectiveDepth;null!=this.triangle3d&&(this.triangle3d.isOrthographic=!this.vwr.tm.perspectiveDepth);this.antialiasEnabled=this.antialiasThisFrame=this.newAntialiasing;this.currentlyRendering=!0;if(null!=this.strings)for(a=Math.min(this.strings.length,this.stringCount);0<=--a;)this.strings[a]=null;this.stringCount=0;this.twoPass=!0;this.isPass2=!1;this.colixCurrent=this.pass2Flag01=0;this.$haveTranslucentObjects=
this.wasScreened=!1;this.pixel=this.pixel0;this.pixel.bgcolor=this.bgcolor;this.translucentCoverOnly=!b;null==this.pbuf&&(this.platform.allocateBuffers(this.windowWidth,this.windowHeight,this.antialiasThisFrame,d),this.pbuf=this.platform.pBuffer,this.zbuf=this.platform.zBuffer,this.aobuf=null,this.pixel0.setBuf(),null!=this.pixelT0&&this.pixelT0.setBuf(),null!=this.pixelShaded&&this.pixelShaded.setBuf());this.setWidthHeight(this.antialiasThisFrame);null!=this.pixelScreened&&(this.pixelScreened.width=
this.width);this.platform.clearBuffer();null!=this.backgroundImage&&this.plotImage(-2147483648,0,-2147483648,this.backgroundImage,null,0,0,0);this.textY=0},"JU.M3,~B,~B,~B");j(c$,"setBackgroundTransparent",function(a){null!=this.platform&&this.platform.setBackgroundTransparent(a)},"~B");c(c$,"releaseBuffers",function(){this.aobuf=this.zbufT=this.pbufT=this.zbuf=this.pbuf=null;this.platform.releaseBuffers();this.line3d.clearLineCache()});j(c$,"setPass2",function(a){if(!this.$haveTranslucentObjects||
!this.currentlyRendering)return!1;this.isPass2=!0;this.pass2Flag01=1;this.colixCurrent=0;if(null==this.pbufT||this.antialias2!=a)this.platform.allocateTBuffers(a),this.pbufT=this.platform.pBufferT,this.zbufT=this.platform.zBufferT;this.antialias2=a;this.antialiasThisFrame&&!this.antialias2&&this.downsampleFullSceneAntialiasing(!0);this.platform.clearTBuffer();null==this.pixelT0&&(this.pixelT0=new J.g3d.PixelatorT(this));null==this.pixel.p0?this.pixel=this.pixelT0:this.pixel.p0=this.pixelT0;return!0},
"~B");j(c$,"endRendering",function(){if(this.currentlyRendering){if(null!=this.pbuf){if(this.isPass2&&null!=this.pbufT)for(var a=this.pbufT.length;0<=--a;)this.pbuf[a]=J.g3d.Graphics3D.mergeBufferPixel(this.pbuf[a],this.pbufT[a],this.bgcolor);this.pixel===this.pixelShaded&&0==this.pixelShaded.zShadePower&&this.pixelShaded.showZBuffer();this.antialiasThisFrame&&this.downsampleFullSceneAntialiasing(!1)}this.platform.setBackgroundColor(this.bgcolor);this.platform.notifyEndOfRendering();this.currentlyRendering=
this.isPass2=!1}});c$.mergeBufferPixel=c(c$,"mergeBufferPixel",function(a,b,d){if(0==b||a==b)return a;0==a&&(a=d);d=a&16711935;a&=65280;var g=b&16711935,c=b&65280;switch(b>>24&15){case 0:d=g;a=c;break;case 1:d=(g<<2)+(g<<1)+g+d>>3&16711935;a=(c<<2)+ +(c<<1)+c+a>>3&65280;break;case 2:d=(g<<1)+g+d>>2&16711935;a=(c<<1)+c+a>>2&65280;break;case 3:d=(g<<2)+g+(d<<1)+d>>3&16711935;a=(c<<2)+c+(a<<1)+a>>3&65280;break;case 4:d=d+g>>1&16711935;a=a+c>>1&65280;break;case 5:d=(g<<1)+g+(d<<2)+d>>3&16711935;a=(c<<
1)+c+(a<<2)+a>>3&65280;break;case 6:d=(d<<1)+d+g>>2&16711935;a=(a<<1)+a+c>>2&65280;break;case 7:d=(d<<2)+(d<<1)+d+g>>3&16711935,a=(a<<2)+(a<<1)+a+c>>3&65280}return 4278190080|d|a},"~N,~N,~N");j(c$,"getScreenImage",function(a){var b=this.platform.bufferedImage;a&&this.releaseBuffers();return b},"~B");j(c$,"applyAnaglygh",function(a,b){switch(a){case J.c.STER.REDCYAN:for(var d=this.anaglyphLength;0<=--d;){var g=this.anaglyphChannelBytes[d]&255;this.pbuf[d]=this.pbuf[d]&4294901760|g<<8|g}break;case J.c.STER.CUSTOM:for(var g=
b[0],c=b[1]&16777215,d=this.anaglyphLength;0<=--d;){var e=this.anaglyphChannelBytes[d]&255,e=(e|(e|e<<8)<<8)&c;this.pbuf[d]=this.pbuf[d]&g|e}break;case J.c.STER.REDBLUE:for(d=this.anaglyphLength;0<=--d;)g=this.anaglyphChannelBytes[d]&255,this.pbuf[d]=this.pbuf[d]&4294901760|g;break;case J.c.STER.REDGREEN:for(d=this.anaglyphLength;0<=--d;)this.pbuf[d]=this.pbuf[d]&4294901760|(this.anaglyphChannelBytes[d]&255)<<8}},"J.c.STER,~A");j(c$,"snapshotAnaglyphChannelBytes",function(){if(this.currentlyRendering)throw new NullPointerException;
this.anaglyphLength=this.windowWidth*this.windowHeight;if(null==this.anaglyphChannelBytes||this.anaglyphChannelBytes.length!=this.anaglyphLength)this.anaglyphChannelBytes=Q(this.anaglyphLength,0);for(var a=this.anaglyphLength;0<=--a;)this.anaglyphChannelBytes[a]=this.pbuf[a]});j(c$,"releaseScreenImage",function(){this.platform.clearScreenBufferThreaded()});j(c$,"haveTranslucentObjects",function(){return this.$haveTranslucentObjects});j(c$,"setSlabAndZShade",function(a,b,d,g,c){this.setSlab(a);this.setDepth(b);
d<g?(null==this.pixelShaded&&(this.pixelShaded=new J.g3d.PixelatorShaded(this)),this.pixel=this.pixelShaded.set(d,g,c)):this.pixel=this.pixel0},"~N,~N,~N,~N,~N");c(c$,"downsampleFullSceneAntialiasing",function(a){var b=this.bgcolor;a&&(b+=255==(b&255)?-1:1);J.g3d.Graphics3D.downsample2d(this.pbuf,this.windowWidth,this.windowHeight,b);a&&(J.g3d.Graphics3D.downsample2dZ(this.pbuf,this.zbuf,this.windowWidth,this.windowHeight,b),this.antialiasThisFrame=!1,this.setWidthHeight(!1))},"~B");c$.downsample2d=
c(c$,"downsample2d",function(a,b,d,g){var c=b<<1;if(0!=g){g&=16777215;for(var e=a.length;0<=--e;)0==a[e]&&(a[e]=g)}for(var h=(g>>2&1061109567)<<2,h=h+((h&3233857728)>>6),k=0,l=0,e=d;0<=--e;l+=c)for(d=b;0<=--d;++k){var j=(a[l]>>2&1061109567)+(a[l++ +c]>>2&1061109567)+(a[l]>>2&1061109567)+(a[l++ +c]>>2&1061109567),j=j+((j&3233857728)>>6);j==h&&(j=g);a[k]=j&16777215|4278190080}},"~A,~N,~N,~N");c$.downsample2dZ=c(c$,"downsample2dZ",function(a,b,d,g,c){for(var e=d<<1,h=0,k=0;0<=--g;k+=e)for(var l=d;0<=
--l;++h,++k){var j=Math.min(b[k],b[k+e]),j=Math.min(j,b[++k]),j=Math.min(j,b[k+e]);2147483647!=j&&(j>>=1);b[h]=a[h]==c?2147483647:j}},"~A,~A,~N,~N,~N");c(c$,"hasContent",function(){return this.platform.hasContent()});j(c$,"setC",function(a){var b=JU.C.isColixLastAvailable(a);if(!b&&a==this.colixCurrent&&-1==this.currentShadeIndex)return!0;var d=a&30720;if(16384==d)return!1;this.renderLow&&(d=0);var g=0!=d,c=g&&30720==d;this.setScreened(c);if(!this.checkTranslucent(g&&!c))return!1;this.isPass2?(this.translucencyMask=
d<<13|16777215,this.translucencyLog=d>>11):this.translucencyLog=0;this.colixCurrent=a;b&&this.argbCurrent!=this.lastRawColor&&(0==this.argbCurrent&&(this.argbCurrent=4294967295),this.lastRawColor=this.argbCurrent,this.shader.setLastColix(this.argbCurrent,this.inGreyscaleMode));this.shadesCurrent=this.getShades(a);this.currentShadeIndex=-1;this.setColor(this.getColorArgbOrGray(a));return!0},"~N");c(c$,"setScreened",function(a){this.wasScreened!=a&&((this.wasScreened=a)?(null==this.pixelScreened&&(this.pixelScreened=
new J.g3d.PixelatorScreened(this,this.pixel0)),null==this.pixel.p0?this.pixel=this.pixelScreened:this.pixel.p0=this.pixelScreened):null==this.pixel.p0||this.pixel===this.pixelScreened?this.pixel=this.isPass2?this.pixelT0:this.pixel0:this.pixel.p0=this.isPass2?this.pixelT0:this.pixel0);return this.pixel},"~B");j(c$,"drawFilledCircle",function(a,b,d,g,c,e){if(!this.isClippedZ(e)){var h=w((d+1)/2),h=g<h||g+h>=this.width||c<h||c+h>=this.height;if(!h||!this.isClippedXY(d,g,c))0!=a&&this.setC(a)&&(h?this.isClippedXY(d,
g,c)||this.circle3d.plotCircleCenteredClipped(g,c,e,d):this.circle3d.plotCircleCenteredUnclipped(g,c,e,d)),0!=b&&this.setC(b)&&(h?this.circle3d.plotFilledCircleCenteredClipped(g,c,e,d):this.circle3d.plotFilledCircleCenteredUnclipped(g,c,e,d))}},"~N,~N,~N,~N,~N,~N");j(c$,"volumeRender4",function(a,b,d,g){if(1==a)this.plotPixelClippedArgb(this.argbCurrent,b,d,g,this.width,this.zbuf,this.pixel);else if(!this.isClippedZ(g)){var c=w((a+1)/2),c=b<c||b+c>=this.width||d<c||d+c>=this.height;if(!c||!this.isClippedXY(a,
b,d))c?this.circle3d.plotFilledCircleCenteredClipped(b,d,g,a):this.circle3d.plotFilledCircleCenteredUnclipped(b,d,g,a)}},"~N,~N,~N,~N");j(c$,"fillSphereXYZ",function(a,b,d,g){switch(a){case 1:this.plotPixelClippedArgb(this.argbCurrent,b,d,g,this.width,this.zbuf,this.pixel);return;case 0:return}a<=(this.antialiasThisFrame?2E3:1E3)&&this.sphere3d.render(this.shadesCurrent,a,b,d,g,null,null,null,-1,null)},"~N,~N,~N,~N");j(c$,"volumeRender",function(a){a?(this.saveAmbient=this.getAmbientPercent(),this.saveDiffuse=
this.getDiffusePercent(),this.setAmbientPercent(100),this.setDiffusePercent(0),this.addRenderer(1073741880)):(this.setAmbientPercent(this.saveAmbient),this.setDiffusePercent(this.saveDiffuse))},"~B");j(c$,"fillSphereI",function(a,b){this.fillSphereXYZ(a,b.x,b.y,b.z)},"~N,JU.P3i");j(c$,"fillSphereBits",function(a,b){this.fillSphereXYZ(a,Math.round(b.x),Math.round(b.y),Math.round(b.z))},"~N,JU.P3");j(c$,"fillEllipsoid",function(a,b,d,g,c,e,h,k,l,j,m){switch(e){case 1:this.plotPixelClippedArgb(this.argbCurrent,
d,g,c,this.width,this.zbuf,this.pixel);return;case 0:return}e<=(this.antialiasThisFrame?2E3:1E3)&&this.sphere3d.render(this.shadesCurrent,e,d,g,c,h,k,l,j,m)},"JU.P3,~A,~N,~N,~N,~N,JU.M3,~A,JU.M4,~N,~A");j(c$,"drawRect",function(a,b,d,g,c,e){if(!(0!=g&&this.isClippedZ(g))){g=c-1;e-=1;c=a+g;var h=b+e;0<=b&&b<this.height&&this.drawHLine(a,b,d,g);0<=h&&h<this.height&&this.drawHLine(a,h,d,g);0<=a&&a<this.width&&this.drawVLine(a,b,d,e);0<=c&&c<this.width&&this.drawVLine(c,b,d,e)}},"~N,~N,~N,~N,~N,~N");
c(c$,"drawHLine",function(a,b,d,c){0>c&&(a+=c,c=-c);0>a&&(c+=a,a=0);a+c>=this.width&&(c=this.width-1-a);var f=this.pixel,e=this.argbCurrent;a+=this.width*b;for(b=0;b<=c;b++)d<this.zbuf[a]&&f.addPixel(a,d,e),a++},"~N,~N,~N,~N");c(c$,"drawVLine",function(a,b,d,c){0>c&&(b+=c,c=-c);0>b&&(c+=b,b=0);b+c>=this.height&&(c=this.height-1-b);a+=this.width*b;b=this.pixel;for(var f=this.argbCurrent,e=0;e<=c;e++)d<this.zbuf[a]&&b.addPixel(a,d,f),a+=this.width},"~N,~N,~N,~N");j(c$,"fillTextRect",function(a,b,d,
c,f,e){if(!this.isClippedZ(c)){c=this.width;if(0>a){f+=a;if(0>=f)return;a=0}if(a+f>c&&(f=c-a,0>=f))return;if(0>b){e+=b;if(0>=e)return;b=0}b+e>this.height&&(e=this.height-b);for(var h=this.argbCurrent,k=this.zbuf,l=this.pixel;0<=--e;)this.plotPixelsUnclippedCount(h,f,a,b++,d,c,k,l)}},"~N,~N,~N,~N,~N,~N");j(c$,"drawString",function(a,b,d,c,f,e,h){this.currentShadeIndex=0;null!=a&&(this.isClippedZ(e)||this.drawStringNoSlab(a,b,d,c,f,h))},"~S,JU.Font,~N,~N,~N,~N,~N");j(c$,"drawStringNoSlab",function(a,
b,d,c,f,e){if(null!=a){null==this.strings&&(this.strings=Array(10));this.stringCount==this.strings.length&&(this.strings=JU.AU.doubleLength(this.strings));var h=new J.g3d.TextString;h.setText(a,null==b?this.currentFont:this.currentFont=b,this.argbCurrent,JU.C.isColixTranslucent(e)?this.getColorArgbOrGray(e)&16777215|(e&30720)<<13:0,d,c,f);this.strings[this.stringCount++]=h}},"~S,JU.Font,~N,~N,~N,~N");j(c$,"renderAllStrings",function(a){if(null!=this.strings){2<=this.stringCount&&(null==J.g3d.Graphics3D.sort&&
(J.g3d.Graphics3D.sort=new J.g3d.TextString),java.util.Arrays.sort(this.strings,J.g3d.Graphics3D.sort));for(var b=0;b<this.stringCount;b++){var d=this.strings[b];this.plotText(d.x,d.y,d.z,d.argb,d.bgargb,d.text,d.font,a)}this.strings=null;this.stringCount=0}},"~O");j(c$,"plotText",function(a,b,d,c,f,e,h,k){J.g3d.TextRenderer.plot(a,b,d,c,f,e,h,this,k,this.antialiasThisFrame)},"~N,~N,~N,~N,~N,~S,JU.Font,J.api.JmolRendererInterface");j(c$,"drawImage",function(a,b,d,c,f,e,h,k){null!=a&&(0<h&&0<k&&!this.isClippedZ(f))&&
this.plotImage(b,d,c,a,null,e,h,k)},"~O,~N,~N,~N,~N,~N,~N,~N");j(c$,"plotImage",function(a,b,d,c,f,e,h,k){this.setC(e);this.isPass2||(this.translucencyMask=-1);0==e&&(this.argbCurrent=0);var l=-2147483648==a;e=l?this.bgcolor:this.argbCurrent;l&&(a=0,d=2147483646,h=this.width,k=this.height);if(!(0>=a+h||a>=this.width||0>=b+k||b>=this.height))if(c=this.apiPlatform.drawImageToBuffer(null,this.platform.offscreenImage,c,h,k,l?e:0),null!=c){var l=this.zbuf,j=this.width,m=this.pixel,r=this.height,x=this.translucencyLog;
if(null==f&&0<=a&&a+h<=j&&0<=b&&b+k<=r){var y=0,F=0;for(a=b*j+a;y<k;y++,a+=j-h)for(var C=0;C<h;C++,F++,a++)if(d<l[a]){var n=c[F];-16777216==(n&4278190080)&&m.addPixel(a,d,n)}}else{null==f&&(f=this);for(F=y=0;y<k;y++)for(C=0;C<h;C++)n=c[F++],-16777216==(n&4278190080)&&f.plotImagePixel(n,a+C,b+y,d,8,e,j,r,l,m,x)}}},"~N,~N,~N,~O,J.api.JmolRendererInterface,~N,~N,~N");j(c$,"setFontFid",function(a){this.currentFont=JU.Font.getFont3D(a)},"~N");j(c$,"setFont",function(a){this.currentFont=a},"JU.Font");j(c$,
"drawPixel",function(a,b,d){this.plotPixelClippedArgb(this.argbCurrent,a,b,d,this.width,this.zbuf,this.pixel)},"~N,~N,~N");j(c$,"drawPoints",function(a,b,d){if(1<d)for(var c=0.8*d*d,f=-d;f<d;f++)for(var e=-d;e<d;e++)f*f+e*e>c||(this.plotPoints(a,b,f,e),this.plotPoints(a,b,f,e));else this.plotPoints(a,b,0,0)},"~N,~A,~N");j(c$,"drawDashedLineBits",function(a,b,d,c){this.isAntialiased()&&(a+=a,b+=b);this.setScreeni(d,this.sA);this.setScreeni(c,this.sB);this.line3d.plotLineBits(this.argbCurrent,this.argbCurrent,
this.sA,this.sB,a,b,!0);this.isAntialiased()&&(Math.abs(d.x-c.x)<Math.abs(d.y-c.y)?(this.sA.x+=1,this.sB.x+=1):(this.sA.y+=1,this.sB.y+=1),this.line3d.plotLineBits(this.argbCurrent,this.argbCurrent,this.sA,this.sB,a,b,!0))},"~N,~N,JU.P3,JU.P3");c(c$,"setScreeni",function(a,b){b.x=Math.round(a.x);b.y=Math.round(a.y);b.z=Math.round(a.z)},"JU.P3,JU.P3i");j(c$,"drawLineXYZ",function(a,b,d,c,f,e){this.line3d.plotLineOld(this.argbCurrent,this.argbCurrent,a,b,d,c,f,e)},"~N,~N,~N,~N,~N,~N");j(c$,"drawLine",
function(a,b,d,c,f,e,h,k){this.setC(a)||(a=0);var l=this.argbCurrent;this.setC(b)||(b=0);(0!=a||0!=b)&&this.line3d.plotLineOld(l,this.argbCurrent,d,c,f,e,h,k)},"~N,~N,~N,~N,~N,~N,~N,~N");j(c$,"drawLineBits",function(a,b,d,c){this.setC(a)||(a=0);var f=this.argbCurrent;this.setC(b)||(b=0);if(0!=a||0!=b)this.setScreeni(d,this.sA),this.setScreeni(c,this.sB),this.line3d.plotLineBits(f,this.argbCurrent,this.sA,this.sB,0,0,!1)},"~N,~N,JU.P3,JU.P3");j(c$,"drawLineAB",function(a,b){this.setScreeni(a,this.sA);
this.setScreeni(b,this.sB);this.line3d.plotLineBits(this.argbCurrent,this.argbCurrent,this.sA,this.sB,0,0,!1)},"JU.P3,JU.P3");j(c$,"fillCylinderXYZ",function(a,b,d,c,f,e,h,k,l,j){if(!(c>this.ht3)){var m=0;this.currentShadeIndex=0;this.setC(b)||(b=0);this.wasScreened&&(m=2);this.setC(a)||(a=0);this.wasScreened&&(m+=1);0==a&&0==b||this.cylinder3d.renderOld(a,b,m,d,c,f,e,h,k,l,j)}},"~N,~N,~N,~N,~N,~N,~N,~N,~N,~N");j(c$,"fillCylinderScreen3I",function(a,b,d,c){b<=this.ht3&&this.cylinder3d.renderOld(this.colixCurrent,
this.colixCurrent,0,a,b,A(d.x),A(d.y),A(d.z),A(c.x),A(c.y),A(c.z))},"~N,~N,JU.P3,JU.P3,JU.P3,JU.P3,~N");j(c$,"fillCylinder",function(a,b,d,c){b<=this.ht3&&this.cylinder3d.renderOld(this.colixCurrent,this.colixCurrent,0,a,b,d.x,d.y,d.z,c.x,c.y,c.z)},"~N,~N,JU.P3i,JU.P3i");j(c$,"fillCylinderBits",function(a,b,d,c){b<=this.ht3&&(1!=d.z&&1!=c.z)&&(0==b||1==b?(this.setScreeni(d,this.sA),this.setScreeni(c,this.sB),this.line3d.plotLineBits(this.getColorArgbOrGray(this.colixCurrent),this.getColorArgbOrGray(this.colixCurrent),
this.sA,this.sB,0,0,!1)):this.cylinder3d.renderBitsFloat(this.colixCurrent,this.colixCurrent,0,a,b,d,c))},"~N,~N,JU.P3,JU.P3");j(c$,"fillCylinderBits2",function(a,b,d,c,f,e){if(!(c>this.ht3)){var h=0;this.currentShadeIndex=0;this.setC(b)||(b=0);this.wasScreened&&(h=2);this.setC(a)||(a=0);this.wasScreened&&(h+=1);0==a&&0==b||(this.setScreeni(f,this.sA),this.setScreeni(e,this.sB),this.cylinder3d.renderBits(a,b,h,d,c,this.sA,this.sB))}},"~N,~N,~N,~N,JU.P3,JU.P3");j(c$,"fillConeScreen3f",function(a,b,
d,c,f){b<=this.ht3&&this.cylinder3d.renderConeOld(this.colixCurrent,a,b,d.x,d.y,d.z,c.x,c.y,c.z,!0,f)},"~N,~N,JU.P3,JU.P3,~B");j(c$,"drawHermite4",function(a,b,d,c,f){this.hermite3d.renderHermiteRope(!1,a,0,0,0,b,d,c,f)},"~N,JU.P3,JU.P3,JU.P3,JU.P3");j(c$,"drawHermite7",function(a,b,d,c,f,e,h,k,l,j,m,r,x){if(0==x)this.hermite3d.renderHermiteRibbon(a,b,d,c,f,e,h,k,l,j,m,r,0);else{this.hermite3d.renderHermiteRibbon(a,b,d,c,f,e,h,k,l,j,m,r,1);var y=this.colixCurrent;this.setC(x);this.hermite3d.renderHermiteRibbon(a,
b,d,c,f,e,h,k,l,j,m,r,-1);this.setC(y)}},"~B,~B,~N,JU.P3,JU.P3,JU.P3,JU.P3,JU.P3,JU.P3,JU.P3,JU.P3,~N,~N");j(c$,"fillHermite",function(a,b,d,c,f,e,h,k){this.hermite3d.renderHermiteRope(!0,a,b,d,c,f,e,h,k)},"~N,~N,~N,~N,JU.P3,JU.P3,JU.P3,JU.P3");j(c$,"drawTriangle3C",function(a,b,d,c,f,e,h){1==(h&1)&&this.drawLine(b,c,a.x,a.y,a.z,d.x,d.y,d.z);2==(h&2)&&this.drawLine(c,e,d.x,d.y,d.z,f.x,f.y,f.z);4==(h&4)&&this.drawLine(b,e,a.x,a.y,a.z,f.x,f.y,f.z)},"JU.P3i,~N,JU.P3i,~N,JU.P3i,~N,~N");j(c$,"fillTriangleTwoSided",
function(a,b,d,c){this.setColorNoisy(this.getShadeIndex(a));this.fillTriangleP3f(b,d,c,!1)},"~N,JU.P3,JU.P3,JU.P3");c(c$,"fillTriangleP3f",function(a,b,d,c){this.setScreeni(a,this.sA);this.setScreeni(b,this.sB);this.setScreeni(d,this.sC);this.triangle3d.fillTriangle(this.sA,this.sB,this.sC,c)},"JU.P3,JU.P3,JU.P3,~B");j(c$,"fillTriangle3f",function(a,b,d,c){var f=this.getShadeIndexP3(a,b,d,c);0>f||(c?this.setColorNoisy(f):this.setColor(this.shadesCurrent[f]),this.fillTriangleP3f(a,b,d,!1))},"JU.P3,JU.P3,JU.P3,~B");
j(c$,"fillTriangle3i",function(a,b,d,c,f,e,h){h&&(c=this.vectorAB,c.set(b.x-a.x,b.y-a.y,b.z-a.z),null==d?c=this.shader.getShadeIndex(-c.x,-c.y,c.z):(this.vectorAC.set(d.x-a.x,d.y-a.y,d.z-a.z),c.cross(c,this.vectorAC),c=0<=c.z?this.shader.getShadeIndex(-c.x,-c.y,c.z):this.shader.getShadeIndex(c.x,c.y,-c.z)),56<c&&(c=56),this.setColorNoisy(c));this.fillTriangleP3f(a,b,d,!1)},"JU.P3,JU.P3,JU.P3,JU.T3,JU.T3,JU.T3,~B");j(c$,"fillTriangle3CN",function(a,b,d,c,f,e,h,k,l){this.triangle3d.fillTriangle(a,c,
h,this.checkGouraud(b,f,k,d,e,l))},"JU.P3i,~N,~N,JU.P3i,~N,~N,JU.P3i,~N,~N");j(c$,"fillTriangle3CNBits",function(a,b,d,c,f,e,h,k,l){this.fillTriangleP3f(a,c,h,this.checkGouraud(b,f,k,d,e,l))},"JU.P3,~N,~N,JU.P3,~N,~N,JU.P3,~N,~N,~B");c(c$,"checkGouraud",function(a,b,d,c,f,e){if(!this.isPass2&&c==f&&c==e&&a==b&&a==d){b=this.getShadeIndex(c);if(a!=this.colixCurrent||this.currentShadeIndex!=b)this.currentShadeIndex=-1,this.setC(a),this.setColorNoisy(b);return!1}this.setTriangleTranslucency(a,b,d);this.triangle3d.setGouraud(this.getShades(a)[this.getShadeIndex(c)],
this.getShades(b)[this.getShadeIndex(f)],this.getShades(d)[this.getShadeIndex(e)]);return!0},"~N,~N,~N,~N,~N,~N");c(c$,"getShadeIndex",function(a){return-1E4==a||9999==a?J.g3d.Graphics3D.nullShadeIndex:0>a?this.shadeIndexes2Sided[~a]:this.shadeIndexes[a]},"~N");c(c$,"setTriangleTranslucency",function(a,b,d){this.isPass2&&(a&=14336,b&=14336,d&=14336,this.translucencyMask=(JU.GData.roundInt(w((a+b+d)/3))&30720)<<13|16777215)},"~N,~N,~N");j(c$,"fillQuadrilateral",function(a,b,d,c,f){f=this.getShadeIndexP3(a,
b,d,f);0>f||(this.setColorNoisy(f),this.fillTriangleP3f(a,b,d,!1),this.fillTriangleP3f(a,d,c,!1))},"JU.P3,JU.P3,JU.P3,JU.P3,~B");j(c$,"drawSurface",function(){},"JU.MeshSurface,~N");j(c$,"plotPixelClippedP3i",function(a){this.plotPixelClippedArgb(this.argbCurrent,a.x,a.y,a.z,this.width,this.zbuf,this.pixel)},"JU.P3i");c(c$,"plotPixelClippedArgb",function(a,b,d,c,f,e,h){this.isClipped3(b,d,c)||(b=d*f+b,c<e[b]&&h.addPixel(b,c,a))},"~N,~N,~N,~N,~N,~A,J.g3d.Pixelator");c(c$,"plotPixelUnclipped",function(a,
b,d,c,f,e,h){b=d*f+b;c<e[b]&&h.addPixel(b,c,a)},"~N,~N,~N,~N,~N,~A,J.g3d.Pixelator");c(c$,"plotImagePixel",function(a,b,d,c,f,e,h,k,l,j,m){0>b||(b>=h||0>d||d>=k)||j.addImagePixel(f,m,d*h+b,c,a,e)},"~N,~N,~N,~N,~N,~N,~N,~N,~A,~O,~N");c(c$,"plotPixelsClippedRaster",function(a,b,d,c,f,e,h){var k,l;if(!(0>=a||0>d||d>=this.height||b>=this.width||c<(l=this.slab)&&f<l||c>(k=this.depth)&&f>k)){var j=this.zbuf,m=(b<<16)+(d<<1)^858993459,r=(c<<10)+512;c=f-c;f=w(a/2);c=JU.GData.roundInt(w(((c<<10)+(0<=c?f:-f))/
a));if(0>b){b=-b;r+=c*b;a-=b;if(0>=a)return;b=0}a+b>this.width&&(a=this.width-b);b=d*this.width+b;d=this.pixel;if(null==e){e=this.argbNoisyDn;f=this.argbNoisyUp;for(var x=this.argbCurrent;0<=--a;){h=r>>10;if(h>=l&&h<=k&&h<j[b]){var m=(m<<16)+(m<<1)+m&2147483647,y=m>>16&7;d.addPixel(b,h,0==y?e:1==y?f:x)}++b;r+=c}}else{m=e.r<<8;f=w((h.r-e.r<<8)/a);x=e.g;y=w((h.g-x)/a);e=e.b;for(var F=w((h.b-e)/a);0<=--a;)h=r>>10,h>=l&&(h<=k&&h<j[b])&&d.addPixel(b,h,4278190080|m&16711680|x&65280|e>>8&255),++b,r+=c,m+=
f,x+=y,e+=F}}},"~N,~N,~N,~N,~N,JU.Rgb16,JU.Rgb16");c(c$,"plotPixelsUnclippedRaster",function(a,b,d,c,f,e,h){if(!(0>=a)){var k=((b<<16)+(d<<1)^858993459)&2147483647,l=(c<<10)+512;c=f-c;f=w(a/2);c=JU.GData.roundInt(w(((c<<10)+(0<=c?f:-f))/a));b=d*this.width+b;d=this.zbuf;f=this.pixel;if(null==e){e=this.argbNoisyDn;for(var j=this.argbNoisyUp,m=this.argbCurrent;0<=--a;){h=l>>10;if(h<d[b]){var k=(k<<16)+(k<<1)+k&2147483647,r=k>>16&7;f.addPixel(b,h,0==r?e:1==r?j:m)}++b;l+=c}}else{k=e.r<<8;j=JU.GData.roundInt(w((h.r-
e.r<<8)/a));m=e.g;r=JU.GData.roundInt(w((h.g-m)/a));e=e.b;for(var x=JU.GData.roundInt(w((h.b-e)/a));0<=--a;)h=l>>10,h<d[b]&&f.addPixel(b,h,4278190080|k&16711680|m&65280|e>>8&255),++b,l+=c,k+=j,m+=r,e+=x}}},"~N,~N,~N,~N,~N,JU.Rgb16,JU.Rgb16");c(c$,"plotPixelsClippedRasterBits",function(a,b,d,c,f,e,h,k,l){var j,m;if(!(0>=a||0>d||d>=this.height||b>=this.width||c<(m=this.slab)&&f<m||c>(j=this.depth)&&f>j)){c=this.zbuf;var r=(b<<16)+(d<<1)^858993459;if(0>b){a-=-b;if(0>=a)return;b=0}a+b>this.width&&(a=
this.width-b);d=d*this.width+b;f=this.pixel;if(null==e){e=this.argbNoisyDn;for(var x=this.argbNoisyUp,y=this.argbCurrent;0<=--a;){h=this.line3d.getZCurrent(k,l,b++);if(h>=m&&h<=j&&h<c[d]){var r=(r<<16)+(r<<1)+r&2147483647,F=r>>16&7;f.addPixel(d,h,2>F?e:6>F?x:y)}++d}}else{r=e.r<<8;x=w((h.r-e.r<<8)/a);y=e.g;F=w((h.g-y)/a);e=e.b;for(var C=w((h.b-e)/a);0<=--a;)h=this.line3d.getZCurrent(k,l,b++),h>=m&&(h<=j&&h<c[d])&&f.addPixel(d,h,4278190080|r&16711680|y&65280|e>>8&255),++d,r+=x,y+=F,e+=C}}},"~N,~N,~N,~N,~N,JU.Rgb16,JU.Rgb16,~N,~N");
c(c$,"plotPixelsUnclippedRasterBits",function(a,b,d,c,f,e,h){if(!(0>=a)){var k=((b<<16)+(d<<1)^858993459)&2147483647;d=d*this.width+b;var l=this.zbuf,j=this.pixel;if(null==c)for(var m=this.argbNoisyDn,r=this.argbNoisyUp,x=this.argbCurrent;0<=--a;)f=this.line3d.getZCurrent(e,h,b++),f<l[d]&&(k=(k<<16)+(k<<1)+k&2147483647,c=k>>16&7,j.addPixel(d,f,0==c?m:1==c?r:x)),++d;else{k=c.r<<8;m=JU.GData.roundInt(w((f.r-c.r<<8)/a));r=c.g;x=JU.GData.roundInt(w((f.g-r)/a));c=c.b;for(var y=JU.GData.roundInt(w((f.b-
c)/a));0<=--a;)f=this.line3d.getZCurrent(e,h,b++),f<l[d]&&j.addPixel(d,f,4278190080|k&16711680|r&65280|c>>8&255),++d,k+=m,r+=x,c+=y}}},"~N,~N,~N,JU.Rgb16,JU.Rgb16,~N,~N");c(c$,"plotPixelsUnclippedCount",function(a,b,d,c,f,e,h,k){for(d=c*e+d;0<=--b;)f<h[d]&&k.addPixel(d,f,a),++d},"~N,~N,~N,~N,~N,~N,~A,J.g3d.Pixelator");c(c$,"plotPoints",function(a,b,d,c){var f=this.pixel,e=this.argbCurrent,h=this.zbuf,k=this.width,l=this.antialiasThisFrame;for(a*=3;0<a;){var j=b[--a],m=b[--a]+c,r=b[--a]+d;if(!this.isClipped3(r,
m,j)){var x=m*k+r++;j<h[x]&&f.addPixel(x,j,e);l&&(x=m*k+r,!this.isClipped3(r,m,j)&&j<h[x]&&f.addPixel(x,j,e),x=++m*k+r,!this.isClipped3(r,m,j)&&j<h[x]&&f.addPixel(x,j,e),x=m*k+--r,!this.isClipped3(r,m,j)&&j<h[x]&&f.addPixel(x,j,e))}}},"~N,~A,~N,~N");c(c$,"setColorNoisy",function(a){this.currentShadeIndex=a;this.argbCurrent=this.shadesCurrent[a];this.argbNoisyUp=this.shadesCurrent[63>a?a+1:63];this.argbNoisyDn=this.shadesCurrent[0<a?a-1:0]},"~N");c(c$,"getShadeIndexP3",function(a,b,d,c){this.vectorAB.sub2(b,
a);this.vectorAC.sub2(d,a);a=this.vectorNormal;a.cross(this.vectorAB,this.vectorAC);return 0>a.z?this.shader.getShadeIndex(a.x,a.y,-a.z):c?-1:this.shader.getShadeIndex(-a.x,-a.y,a.z)},"JU.P3,JU.P3,JU.P3,~B");j(c$,"renderBackground",function(a){null!=this.backgroundImage&&this.plotImage(-2147483648,0,-2147483648,this.backgroundImage,a,0,0,0)},"J.api.JmolRendererInterface");j(c$,"drawAtom",function(a){this.fillSphereXYZ(a.sD,a.sX,a.sY,a.sZ)},"JM.Atom,~N");j(c$,"getExportType",function(){return 0});
j(c$,"getExportName",function(){return null});c(c$,"canDoTriangles",function(){return!0});c(c$,"isCartesianExport",function(){return!1});j(c$,"initializeExporter",function(){return null},"JV.Viewer,~N,JU.GData,java.util.Map");j(c$,"finalizeOutput",function(){return null});j(c$,"drawBond",function(){},"JU.P3,JU.P3,~N,~N,~N,~N,~N");j(c$,"drawEllipse",function(){return!1},"JU.P3,JU.P3,JU.P3,~B,~B");c(c$,"getPrivateKey",function(){return 0});j(c$,"clearFontCache",function(){J.g3d.TextRenderer.clearFontCache()});
c(c$,"setRotationMatrix",function(a){for(var b=JU.Normix.getVertexVectors(),d=JU.GData.normixCount;0<=--d;){var c=this.transformedVectors[d];a.rotate2(b[d],c);this.shadeIndexes[d]=this.shader.getShadeB(c.x,-c.y,c.z);this.shadeIndexes2Sided[d]=0<=c.z?this.shadeIndexes[d]:this.shader.getShadeB(-c.x,c.y,-c.z)}},"JU.M3");j(c$,"renderCrossHairs",function(a,b,d,c,f){b=this.isAntialiased();this.setC(0>f?10:100<f?11:23);f=Math.max(Math.min(this.width,Math.round(c.x)),0);d=Math.max(Math.min(this.height,Math.round(c.y)),
0);var e=Math.round(c.z)+1,h=b?8:4,k=b?20:10;b=b?2:1;this.drawRect(f-h,d,e,0,k,b);this.drawRect(f,d-h,e,0,b,k);this.drawRect(f-h,d-h,e,0,k,k);h=k;k>>=1;this.setC(a[1]<c.x?21:11);this.drawRect(f-h,d,e,0,k,b);this.setC(a[0]>c.x?21:11);this.drawRect(f+k,d,e,0,k,b);this.setC(a[3]<c.y?21:11);this.drawRect(f,d-h,e,0,b,k);this.setC(a[2]>c.y?21:11);this.drawRect(f,d+k,e,0,b,k)},"~A,~N,~N,JU.P3,~N");j(c$,"initializeOutput",function(){return!1},"JV.Viewer,~N,java.util.Map");E(c$,"sort",null,"nullShadeIndex",
50)});s("J.g3d");v(["J.g3d.PrecisionRenderer","java.util.Hashtable"],"J.g3d.LineRenderer",["java.lang.Float","JU.BS"],function(){c$=t(function(){this.lineBits=this.shader=this.g3d=null;this.slope=0;this.lineTypeX=!1;this.nBits=0;this.slopeKey=this.lineCache=null;this.z2t=this.y2t=this.x2t=this.z1t=this.y1t=this.x1t=0;p(this,arguments)},J.g3d,"LineRenderer",J.g3d.PrecisionRenderer);O(c$,function(){this.lineCache=new java.util.Hashtable});q(c$,function(a){I(this,J.g3d.LineRenderer,[]);this.g3d=a;this.shader=
a.shader},"J.g3d.Graphics3D");c(c$,"setLineBits",function(a,b){this.slope=0!=a?b/a:0<=b?3.4028235E38:-3.4028235E38;this.nBits=(this.lineTypeX=1>=this.slope&&-1<=this.slope)?this.g3d.width:this.g3d.height;this.slopeKey=Float.$valueOf(this.slope);if(this.lineCache.containsKey(this.slopeKey))this.lineBits=this.lineCache.get(this.slopeKey);else{this.lineBits=JU.BS.newN(this.nBits);b=Math.abs(b);a=Math.abs(a);if(b>a){var d=a;a=b;b=d}for(var d=0,c=a+a,f=b+b,e=0;e<this.nBits;e++)d+=f,d>a&&(this.lineBits.set(e),
d-=c);this.lineCache.put(this.slopeKey,this.lineBits)}},"~N,~N");c(c$,"clearLineCache",function(){this.lineCache.clear()});c(c$,"plotLineOld",function(a,b,d,c,f,e,h,k){this.x1t=d;this.x2t=e;this.y1t=c;this.y2t=h;this.z1t=f;this.z2t=k;var l=!0;switch(this.getTrimmedLineImpl()){case 0:l=!1;break;case 2:return}this.plotLineClippedOld(a,b,d,c,f,e-d,h-c,k-f,l,0,0)},"~N,~N,~N,~N,~N,~N,~N,~N");c(c$,"plotLineDeltaOld",function(a,b,d,c,f,e,h,k,l){this.x1t=d;this.x2t=d+e;this.y1t=c;this.y2t=c+h;this.z1t=f;
this.z2t=f+k;if(l)switch(this.getTrimmedLineImpl()){case 2:return;case 0:l=!1}this.plotLineClippedOld(a,b,d,c,f,e,h,k,l,0,0)},"~N,~N,~N,~N,~N,~N,~N,~N,~B");c(c$,"plotLineDeltaAOld",function(a,b,d,c,f,e,h,k,l,j,m){this.x1t=f;this.x2t=f+k;this.y1t=e;this.y2t=e+l;this.z1t=h;this.z2t=h+j;if(m)switch(this.getTrimmedLineImpl()){case 2:return;case 0:m=!1}var r=this.g3d.zbuf,x=this.g3d.width,y=0,F=e*x+f,C=this.g3d.bufferSize,n=63>c?c+1:c,p=0<c?c-1:c,q=a[n],s=a[p],t=b[c],n=b[n];b=b[p];a=a[c];c=this.g3d.pixel;
0!=d&&(c=this.g3d.setScreened(1==(d&1)),this.g3d.currentShadeIndex=0);0!=a&&(!m&&0<=F&&F<C&&h<r[F])&&c.addPixel(F,h,a);if(!(0==k&&0==l)){m=1;p=x;f+=k;var u=e+l;0>k&&(k=-k,m=-1);0>l&&(l=-l,p=-x);x=k+k;e=l+l;h<<=10;if(l<=k){var v=k-1;0>j&&(v=-v);j=w(((j<<10)+v)/k);l=0;v=Math.abs(f-this.x2t)-1;f=Math.abs(f-this.x1t)-1;for(var u=k-1,A=w(u/2);--u>=v;){if(u==A){a=t;if(0==a)break;q=n;s=b;0!=d%3&&(c=this.g3d.setScreened(2==(d&2)),this.g3d.currentShadeIndex=0)}F+=m;h+=j;l+=e;l>k&&(F+=p,l-=x);if(0!=a&&u<f&&
0<=F&&F<C&&2147483647>y){var B=h>>10;if(B<r[F]){var D=this.shader.nextRandom8Bit();c.addPixel(F,B,85>D?s:170<D?q:a)}}y=(y+1)%1}}else{v=l-1;0>j&&(v=-v);j=w(((j<<10)+v)/l);k=0;v=Math.abs(u-this.y2t)-1;f=Math.abs(u-this.y1t)-1;u=l-1;for(A=w(u/2);--u>=v;){if(u==A){a=t;if(0==a)break;q=n;s=b;0!=d%3&&(c=this.g3d.setScreened(2==(d&2)),this.g3d.currentShadeIndex=0)}F+=p;h+=j;k+=x;k>l&&(F+=m,k-=e);0!=a&&(u<f&&0<=F&&F<C&&2147483647>y)&&(B=h>>10,B<r[F]&&(D=this.g3d.shader.nextRandom8Bit(),c.addPixel(F,B,85>D?
s:170<D?q:a)));y=(y+1)%1}}}},"~A,~A,~N,~N,~N,~N,~N,~N,~N,~N,~B");c(c$,"plotLineDeltaABitsFloat",function(a,b,d,c,f,e,h){var k=Math.round(c.x),l=Math.round(c.y),j=Math.round(c.z),m=Math.round(f.x),r=Math.round(f.y),x=Math.round(f.z),y=m-k,F=r-l;this.x1t=k;this.x2t=m;this.y1t=l;this.y2t=r;this.z1t=j;this.z2t=x;if(!(h&&2==this.getTrimmedLineImpl())){h=this.g3d.zbuf;var C=this.g3d.width,m=0,x=63>d?d+1:d,r=0<d?d-1:d,n=a[d],p=a[x],q=a[r];d=b[d];a=b[x];b=b[r];var r=l*C+k,x=this.g3d.bufferSize,s,t,u,v;this.lineTypeX?
(s=k,t=this.x1t,u=this.x2t,k+=w(y/2),v=l=0<=y?1:-1,y=0<=F?C:-C,this.setRastABFloat(c.x,c.z,f.x,f.z)):(s=l,t=this.y1t,u=this.y2t,k=l+w(F/2),l=0<=F?1:-1,v=0<=F?C:-C,y=0<=y?1:-1,this.setRastABFloat(c.y,c.z,f.y,f.z));c=j;f=n;j=p;F=q;p=!1;q=this.g3d.pixel;0!=e&&(q=this.g3d.setScreened(1==(e&1)),this.g3d.currentShadeIndex=0);for(n=s;;n+=l,s+=l){n==t&&(p=!0);if(n==k){f=d;if(0==f)break;j=a;F=b;0!=e%3&&(q=this.g3d.setScreened(2==(e&2)),this.g3d.currentShadeIndex=0)}0!=f&&(p&&0<=r&&r<x&&2147483647>m)&&(c=this.getZCurrent(this.a,
this.b,n),c<h[r]&&(C=this.shader.nextRandom8Bit(),q.addPixel(r,A(c),85>C?F:170<C?j:f)));if(n==u)break;m=(m+1)%1;for(r+=v;0>s;)s+=this.nBits;this.lineBits.get(s%this.nBits)&&(r+=y)}}},"~A,~A,~N,JU.P3,JU.P3,~N,~B");c(c$,"plotLineDeltaABitsInt",function(a,b,d,c,f,e,h){var k=c.x,l=c.y,j=c.z,m=f.x,r=f.y,x=f.z,y=m-k,F=r-l;this.x1t=k;this.x2t=m;this.y1t=l;this.y2t=r;this.z1t=j;this.z2t=x;if(!(h&&2==this.getTrimmedLineImpl())){h=this.g3d.zbuf;var C=this.g3d.width,m=0,x=63>d?d+1:d,r=0<d?d-1:d,n=a[d],p=a[x],
q=a[r];d=b[d];a=b[x];b=b[r];var r=l*C+k,x=this.g3d.bufferSize,s,t,u,v;this.lineTypeX?(s=k,t=this.x1t,u=this.x2t,k+=w(y/2),v=l=0<=y?1:-1,y=0<=F?C:-C,this.setRastAB(c.x,c.z,f.x,f.z)):(s=l,t=this.y1t,u=this.y2t,k=l+w(F/2),l=0<=F?1:-1,v=0<=F?C:-C,y=0<=y?1:-1,this.setRastAB(c.y,c.z,f.y,f.z));c=j;f=n;j=p;F=q;p=!1;q=this.g3d.pixel;0!=e&&(q=this.g3d.setScreened(1==(e&1)),this.g3d.currentShadeIndex=0);for(n=s;;n+=l,s+=l){n==t&&(p=!0);if(n==k){f=d;if(0==f)break;j=a;F=b;0!=e%3&&(q=this.g3d.setScreened(2==(e&
2)),this.g3d.currentShadeIndex=0)}0!=f&&(p&&0<=r&&r<x&&2147483647>m)&&(c=this.getZCurrent(this.a,this.b,n),c<h[r]&&(C=this.shader.nextRandom8Bit(),q.addPixel(r,A(c),85>C?F:170<C?j:f)));if(n==u)break;m=(m+1)%1;for(r+=v;0>s;)s+=this.nBits;this.lineBits.get(s%this.nBits)&&(r+=y)}}},"~A,~A,~N,JU.P3i,JU.P3i,~N,~B");c(c$,"plotLineBits",function(a,b,d,c,f,e,h){if(!(1>=d.z||1>=c.z)){var k=!0;this.x1t=d.x;this.y1t=d.y;this.z1t=d.z;this.x2t=c.x;this.y2t=c.y;this.z2t=c.z;switch(this.getTrimmedLineImpl()){case 2:return;
case 0:k=!1;break;default:h&&(d.set(this.x1t,this.y1t,this.z1t),c.set(this.x2t,this.y2t,this.z2t))}h=this.g3d.zbuf;var l=this.g3d.width,j=0;0==f&&(e=2147483647,f=1);var m=d.x,r=d.y,x=d.z,y=c.x-m,F=m+y,C=c.y-r,n=r+C,p=r*l+m,s=this.g3d.bufferSize,q=this.g3d.pixel;0!=a&&(!k&&0<=p&&p<s&&x<h[p])&&q.addPixel(p,x,a);if(!(0==y&&0==C)){var t=k=1,x=l;0>y&&(y=-y,k=-1);0>C&&(C=-C,x=-l,t=-1);var l=y+y,u=C+C;if(C<=y){this.setRastAB(d.x,d.z,c.x,c.z);r=0;d=Math.abs(F-this.x2t)-1;F=Math.abs(F-this.x1t)-1;n=y-1;for(c=
w(n/2);--n>=d&&!(n==c&&(a=b,0==a));){p+=k;m+=k;r+=u;r>y&&(p+=x,r-=l);if(0!=a&&n<F&&0<=p&&p<s&&j<e){var v=this.getZCurrent(this.a,this.b,m);v<h[p]&&q.addPixel(p,v,a)}j=(j+1)%f}}else{this.setRastAB(d.y,d.z,c.y,c.z);m=0;d=Math.abs(n-this.y2t)-1;F=Math.abs(n-this.y1t)-1;n=C-1;for(c=w(n/2);--n>=d&&!(n==c&&(a=b,0==a));)p+=x,r+=t,m+=l,m>C&&(p+=k,m-=u),0!=a&&(n<F&&0<=p&&p<s&&j<e)&&(v=this.getZCurrent(this.a,this.b,r),v<h[p]&&q.addPixel(p,v,a)),j=(j+1)%f}}}},"~N,~N,JU.P3i,JU.P3i,~N,~N,~B");c(c$,"getTrimmedLineImpl",
function(){var a=this.g3d.clipCode3(this.x1t,this.y1t,this.z1t),b=this.g3d.clipCode3(this.x2t,this.y2t,this.z2t);if(0==(a|b))return 0;if(-1==(a|b))return 2;var d=this.g3d.xLast,c=this.g3d.yLast,f=this.g3d.slab,e=this.g3d.depth;do{if(0!=(a&b))return 2;var h=this.x2t-this.x1t,k=this.y2t-this.y1t,l=this.z2t-this.z1t;0!=a?(0!=(a&8)?(this.y1t+=A(-this.x1t*k/h),this.z1t+=A(-this.x1t*l/h),this.x1t=0):0!=(a&4)?(this.y1t+=A((d-this.x1t)*k/h),this.z1t+=A((d-this.x1t)*l/h),this.x1t=d):0!=(a&2)?(this.x1t+=A(-this.y1t*
h/k),this.z1t+=A(-this.y1t*l/k),this.y1t=0):0!=(a&1)?(this.x1t+=A((c-this.y1t)*h/k),this.z1t+=A((c-this.y1t)*l/k),this.y1t=c):0!=(a&32)?(this.x1t+=A((f-this.z1t)*h/l),this.y1t+=A((f-this.z1t)*k/l),this.z1t=f):(this.x1t+=A((e-this.z1t)*h/l),this.y1t+=A((e-this.z1t)*k/l),this.z1t=e),a=this.g3d.clipCode3(this.x1t,this.y1t,this.z1t)):(0!=(b&8)?(this.y2t+=A(-this.x2t*k/h),this.z2t+=A(-this.x2t*l/h),this.x2t=0):0!=(b&4)?(this.y2t+=A((d-this.x2t)*k/h),this.z2t+=A((d-this.x2t)*l/h),this.x2t=d):0!=(b&2)?(this.x2t+=
A(-this.y2t*h/k),this.z2t+=A(-this.y2t*l/k),this.y2t=0):0!=(b&1)?(this.x2t+=A((c-this.y2t)*h/k),this.z2t+=A((c-this.y2t)*l/k),this.y2t=c):0!=(b&32)?(this.x2t+=A((f-this.z2t)*h/l),this.y2t+=A((f-this.z2t)*k/l),this.z2t=f):(this.x2t+=A((e-this.z2t)*h/l),this.y2t+=A((e-this.z2t)*k/l),this.z2t=e),b=this.g3d.clipCode3(this.x2t,this.y2t,this.z2t))}while(0!=(a|b));return 1});c(c$,"plotLineClippedOld",function(a,b,d,c,f,e,h,k,l,j,m){var r=this.g3d.zbuf,x=this.g3d.width,y=0;0==j&&(m=2147483647,j=1);var F=
c*x+d,C=this.g3d.bufferSize,n=this.g3d.pixel;0!=a&&(!l&&0<=F&&F<C&&f<r[F])&&n.addPixel(F,f,a);if(!(0==e&&0==h)){l=1;var p=x;d+=e;var s=c+h;0>e&&(e=-e,l=-1);0>h&&(h=-h,p=-x);x=e+e;c=h+h;f<<=10;if(h<=e){var q=e-1;0>k&&(q=-q);k=w(((k<<10)+q)/e);h=0;q=Math.abs(d-this.x2t)-1;d=Math.abs(d-this.x1t)-1;for(var s=e-1,t=w(s/2);--s>=q&&!(s==t&&(a=b,0==a));){F+=l;f+=k;h+=c;h>e&&(F+=p,h-=x);if(0!=a&&s<d&&0<=F&&F<C&&y<m){var u=f>>10;u<r[F]&&n.addPixel(F,u,a)}y=(y+1)%j}}else{q=h-1;0>k&&(q=-q);k=w(((k<<10)+q)/h);
e=0;q=Math.abs(s-this.y2t)-1;d=Math.abs(s-this.y1t)-1;s=h-1;for(t=w(s/2);--s>=q&&!(s==t&&(a=b,0==a));)F+=p,f+=k,e+=x,e>h&&(F+=l,e-=c),0!=a&&(s<d&&0<=F&&F<C&&y<m)&&(u=f>>10,u<r[F]&&n.addPixel(F,u,a)),y=(y+1)%j}}},"~N,~N,~N,~N,~N,~N,~N,~N,~B,~N,~N");E(c$,"VISIBILITY_UNCLIPPED",0,"VISIBILITY_CLIPPED",1,"VISIBILITY_OFFSCREEN",2)});s("J.g3d");v(null,"J.g3d.Pixelator",["J.g3d.Graphics3D"],function(){c$=t(function(){this.pb=this.zb=this.p0=this.g=null;this.bgcolor=this.width=0;p(this,arguments)},J.g3d,"Pixelator");
q(c$,function(a){this.g=a;this.bgcolor=this.g.bgcolor;this.setBuf()},"J.g3d.Graphics3D");c(c$,"setBuf",function(){this.zb=this.g.zbuf;this.pb=this.g.pbuf});c(c$,"clearPixel",function(a,b){this.zb[a]>b&&(this.zb[a]=2147483647)},"~N,~N");c(c$,"addPixel",function(a,b,d){this.zb[a]=b;this.pb[a]=d},"~N,~N,~N");c(c$,"addImagePixel",function(a,b,d,c,f,e){if(c<this.zb[d])switch(a){case 0:break;case 8:this.addPixel(d,c,f);break;default:a+=b,7>=a&&(b=this.pb[d],0!=e&&(b=J.g3d.Graphics3D.mergeBufferPixel(b,
e,e)),b=J.g3d.Graphics3D.mergeBufferPixel(b,f&16777215|a<<24,this.bgcolor),this.addPixel(d,c,b))}},"~N,~N,~N,~N,~N,~N")});s("J.g3d");v(["J.g3d.Pixelator"],"J.g3d.PixelatorT",["J.g3d.Graphics3D"],function(){c$=D(J.g3d,"PixelatorT",J.g3d.Pixelator);j(c$,"clearPixel",function(){},"~N,~N");j(c$,"addPixel",function(a,b,d){var c=this.g.zbufT[a];if(b<c){var f=this.g.pbufT[a];!this.g.translucentCoverOnly&&(0!=f&&c-b>this.g.zMargin)&&(this.pb[a]=J.g3d.Graphics3D.mergeBufferPixel(this.pb[a],f,this.g.bgcolor));
this.g.zbufT[a]=b;this.g.pbufT[a]=d&this.g.translucencyMask}else b!=c&&!this.g.translucentCoverOnly&&b-c>this.g.zMargin&&(this.pb[a]=J.g3d.Graphics3D.mergeBufferPixel(this.pb[a],d&this.g.translucencyMask,this.g.bgcolor))},"~N,~N,~N")});s("J.g3d");v(["J.g3d.Pixelator"],"J.g3d.PixelatorShaded",null,function(){c$=t(function(){this.tmp=this.bgRGB=null;this.zShadePower=this.zDepth=this.zSlab=0;p(this,arguments)},J.g3d,"PixelatorShaded",J.g3d.Pixelator);q(c$,function(a){I(this,J.g3d.PixelatorShaded,[a]);
this.tmp=B(3,0)},"J.g3d.Graphics3D");c(c$,"set",function(a,b,d){this.bgcolor=this.g.bgcolor;this.bgRGB=B(-1,[this.bgcolor&255,this.bgcolor>>8&255,this.g.bgcolor>>16&255]);this.zSlab=0>a?0:a;this.zDepth=0>b?0:b;this.zShadePower=d;this.p0=this.g.pixel0;return this},"~N,~N,~N");j(c$,"addPixel",function(a,b,d){if(!(b>this.zDepth)){if(b>=this.zSlab&&0<this.zShadePower){var c=this.tmp,f=this.bgRGB;c[0]=d;c[1]=d>>8;c[2]=d>>16;var e=(this.zDepth-b)/(this.zDepth-this.zSlab);if(1<this.zShadePower)for(var h=
0;h<this.zShadePower;h++)e*=e;for(h=0;3>h;h++)c[h]=f[h]+A(e*((c[h]&255)-f[h]));d=c[2]<<16|c[1]<<8|c[0]|d&4278190080}this.p0.addPixel(a,b,d)}},"~N,~N,~N");c(c$,"showZBuffer",function(){for(var a=this.p0.zb.length;0<=--a;)if(0!=this.p0.pb[a]){var b=A(Math.min(255,Math.max(0,255*(this.zDepth-this.p0.zb[a])/(this.zDepth-this.zSlab))));this.p0.pb[a]=4278190080|b|b<<8|b<<16}})});s("J.g3d");v(["J.g3d.Pixelator"],"J.g3d.PixelatorScreened",null,function(){c$=D(J.g3d,"PixelatorScreened",J.g3d.Pixelator);q(c$,
function(a,b){I(this,J.g3d.PixelatorScreened,[a]);this.width=a.width;this.p0=b},"J.g3d.Graphics3D,J.g3d.Pixelator");j(c$,"addPixel",function(a,b,d){a%this.width%2==w(a/this.width)%2&&this.p0.addPixel(a,b,d)},"~N,~N,~N")});s("J.g3d");c$=t(function(){this.bufferSizeT=this.bufferSize=this.bufferHeight=this.bufferWidth=this.windowSize=this.windowHeight=this.windowWidth=0;this.zBufferT=this.zBuffer=this.pBufferT=this.pBuffer=this.bufferedImage=null;this.heightOffscreen=this.widthOffscreen=0;this.apiPlatform=
this.graphicsForTextOrImage=this.offscreenImage=null;p(this,arguments)},J.g3d,"Platform3D");q(c$,function(a){this.apiPlatform=a},"J.api.GenericPlatform");c(c$,"getGraphicsForMetrics",function(){return this.apiPlatform.getGraphics(this.allocateOffscreenImage(1,1))});c(c$,"allocateTBuffers",function(a){this.bufferSizeT=a?this.bufferSize:this.windowSize;this.zBufferT=B(this.bufferSizeT,0);this.pBufferT=B(this.bufferSizeT,0)},"~B");c(c$,"allocateBuffers",function(a,b,d,c){this.windowWidth=a;this.windowHeight=
b;this.windowSize=a*b;d&&(a*=2,b*=2);this.bufferWidth=a;this.bufferHeight=b;this.bufferSize=this.bufferWidth*this.bufferHeight;this.zBuffer=B(this.bufferSize,0);this.pBuffer=B(this.bufferSize,0);this.bufferedImage=this.apiPlatform.allocateRgbImage(this.windowWidth,this.windowHeight,this.pBuffer,this.windowSize,J.g3d.Platform3D.backgroundTransparent,c)},"~N,~N,~B,~B");c(c$,"releaseBuffers",function(){this.windowWidth=this.windowHeight=this.bufferWidth=this.bufferHeight=this.bufferSize=-1;null!=this.bufferedImage&&
(this.apiPlatform.flushImage(this.bufferedImage),this.bufferedImage=null);this.zBufferT=this.pBufferT=this.zBuffer=this.pBuffer=null});c(c$,"hasContent",function(){for(var a=this.bufferSize;0<=--a;)if(2147483647!=this.zBuffer[a])return!0;return!1});c(c$,"clearScreenBuffer",function(){for(var a=this.bufferSize;0<=--a;)this.zBuffer[a]=2147483647,this.pBuffer[a]=0});c(c$,"setBackgroundColor",function(a){if(null!=this.pBuffer)for(var b=this.bufferSize;0<=--b;)0==this.pBuffer[b]&&(this.pBuffer[b]=a)},
"~N");c(c$,"clearTBuffer",function(){for(var a=this.bufferSizeT;0<=--a;)this.zBufferT[a]=2147483647,this.pBufferT[a]=0});c(c$,"clearBuffer",function(){this.clearScreenBuffer()});c(c$,"clearScreenBufferThreaded",function(){});c(c$,"notifyEndOfRendering",function(){this.apiPlatform.notifyEndOfRendering()});c(c$,"getGraphicsForTextOrImage",function(a,b){if(a>this.widthOffscreen||b>this.heightOffscreen)null!=this.offscreenImage&&(this.apiPlatform.disposeGraphics(this.graphicsForTextOrImage),this.apiPlatform.flushImage(this.offscreenImage)),
a>this.widthOffscreen&&(this.widthOffscreen=a),b>this.heightOffscreen&&(this.heightOffscreen=b),this.offscreenImage=this.allocateOffscreenImage(this.widthOffscreen,this.heightOffscreen),this.graphicsForTextOrImage=this.apiPlatform.getStaticGraphics(this.offscreenImage,J.g3d.Platform3D.backgroundTransparent);return this.graphicsForTextOrImage},"~N,~N");c(c$,"allocateOffscreenImage",function(a,b){return this.apiPlatform.newOffScreenImage(a,b)},"~N,~N");c(c$,"setBackgroundTransparent",function(a){J.g3d.Platform3D.backgroundTransparent=
a},"~B");E(c$,"backgroundTransparent",!1);s("J.g3d");c$=t(function(){this.b=this.a=0;this.isOrthographic=!1;p(this,arguments)},J.g3d,"PrecisionRenderer");c(c$,"getZCurrent",function(a,b,d){return Math.round(1.4E-45==a?b:this.isOrthographic?a*d+b:a/(b-d))},"~N,~N,~N");c(c$,"setRastABFloat",function(a,b,d,c){var f=c-b,e=d-a;0==f||0==e?(this.a=1.4E-45,this.b=b):this.isOrthographic?(this.a=f/e,this.b=b-this.a*a):(this.a=e*b*(c/f),this.b=(d*c-a*b)/f)},"~N,~N,~N,~N");c(c$,"setRastAB",function(a,b,d,c){var f=
c-b,e=d-a;1.4E-45==a||0==f||0==e?(this.a=1.4E-45,this.b=c):this.isOrthographic?(this.a=f/e,this.b=b-this.a*a):(this.a=e*b*(c/f),this.b=(d*c-a*b)/f)},"~N,~N,~N,~N");s("J.g3d");v(["JU.P3"],"J.g3d.SphereRenderer",null,function(){c$=t(function(){this.mDeriv=this.coef=this.mat=this.zroot=this.shader=this.g3d=null;this.planeShade=this.selectedOctant=0;this.zbuf=null;this.offsetPbufBeginLine=this.slab=this.depth=this.height=this.width=0;this.dxyz=this.planeShades=this.ptTemp=null;p(this,arguments)},J.g3d,
"SphereRenderer");O(c$,function(){this.zroot=X(2,0);this.ptTemp=new JU.P3;this.planeShades=B(3,0);this.dxyz=K(3,3,0)});q(c$,function(a){this.g3d=a;this.shader=a.shader},"J.g3d.Graphics3D");c(c$,"render",function(a,b,d,c,f,e,h,k,l,j){if(1!=f&&(49<b&&(b&=-2),!this.g3d.isClippedXY(b,d,c))){this.slab=this.g3d.slab;this.depth=this.g3d.depth;var m=b+1>>1,r=f-m;if(!(f+m<this.slab||r>this.depth)){var x=d-m,y=d+m,F=c-m,C=c+m;this.shader.nOut=this.shader.nIn=0;this.zbuf=this.g3d.zbuf;this.height=this.g3d.height;
this.width=this.g3d.width;this.offsetPbufBeginLine=this.width*c+d;var n=this.shader;this.mat=e;if(null!=e&&(this.coef=h,this.mDeriv=k,this.selectedOctant=l,null==n.ellipsoidShades&&n.createEllipsoidShades(),null!=j)){this.planeShade=-1;for(h=0;3>h;h++)if(m=this.dxyz[h][0]=j[h].x-d,k=this.dxyz[h][1]=j[h].y-c,l=this.dxyz[h][2]=j[h].z-f,this.planeShades[h]=n.getShadeIndex(m,k,-l),0==m&&0==k){this.planeShade=this.planeShades[h];break}}if(null!=e||128<b)this.renderQuadrant(-1,-1,d,c,f,b,a),this.renderQuadrant(-1,
1,d,c,f,b,a),this.renderQuadrant(1,-1,d,c,f,b,a),this.renderQuadrant(1,1,d,c,f,b,a),null!=e&&(this.mDeriv=this.coef=this.mat=null);else{var p=n.sphereShapeCache[b-1];if(null==p){p=0;e=0!=(b&1);j=b/2;k=j*j;m=w((b+1)/2);l=e?0:0.5;for(h=0;h<m;++h,++l)for(var s=l*l,q=e?0:0.5,t=0;t<m;++t,++q){var u=q*q,u=k-s-u;0<=u&&++p}var p=B(p,0),v=0;l=e?0:0.5;for(h=0;h<m;++h,++l){s=l*l;q=e?0:0.5;for(t=0;t<m;++t,++q)if(u=q*q,u=k-s-u,0<=u){var D=Math.sqrt(u),u=A(D),G=n.getShadeN(q,l,D,j),E=n.getShadeN(-q,l,D,j),H=n.getShadeN(q,
-l,D,j),D=n.getShadeN(-q,-l,D,j),u=u|G<<7|E<<13|H<<19|D<<25;p[v++]=u}p[v-1]|=2147483648}n.sphereShapeCache[b-1]=p}0>x||y>=this.width||0>F||C>=this.height||r<this.slab||f>this.depth?this.renderSphereClipped(p,d,c,f,b,a):this.renderSphereUnclipped(p,f,b,a)}this.zbuf=null}}},"~A,~N,~N,~N,~N,JU.M3,~A,JU.M4,~N,~A");c(c$,"renderSphereUnclipped",function(a,b,d,c){var f=0,e=1-(d&1),h=this.offsetPbufBeginLine,k=h-e*this.width;d=w((d+1)/2);var l=this.zbuf,j=this.width,m=this.g3d.pixel;do{var r=h,x=h-e,y=k,
n=k-e,C;do{C=a[f++];var p=b-(C&127);p<l[r]&&m.addPixel(r,p,c[C>>7&63]);p<l[x]&&m.addPixel(x,p,c[C>>13&63]);p<l[y]&&m.addPixel(y,p,c[C>>19&63]);p<l[n]&&m.addPixel(n,p,c[C>>25&63]);++r;--x;++y;--n}while(0<=C);h+=j;k-=j}while(0<--d)},"~A,~N,~N,~A");c(c$,"renderSphereClipped",function(a,b,d,c,f,e){var h=this.width,k=this.height,l=0,j=1-(f&1),m=this.offsetPbufBeginLine,r=m-j*h;f=w((f+1)/2);var x=d,y=d-j;d=(b<<16)+(d<<1)^858993459;var n=this.zbuf,C=this.g3d.pixel,p=this.slab,q=this.depth;do{var s=0<=x&&
x<k,t=0<=y&&y<k,u=m,v=m-j,A=r,B=r-j,D,G=b,E=b-j;do{var H=0<=E&&E<h,I=0<=G&&G<h;D=a[l++];var K;K=D&127;var L;c<p?(L=c+K,K=L>=p):(L=c-K,K=L<p);K&&(L=p);if(L>=p&&L<=q){if(s){if(I&&L<n[u]){var M=K?44+(d>>7&7):D>>7&63;C.addPixel(u,L,e[M])}H&&L<n[v]&&(M=K?44+(d>>13&7):D>>13&63,C.addPixel(v,L,e[M]))}t&&(I&&L<n[A]&&(M=K?44+(d>>19&7):D>>19&63,C.addPixel(A,L,e[M])),H&&L<n[B]&&(M=K?44+(d>>25&7):D>>25&63,C.addPixel(B,L,e[M])))}++u;--v;++A;--B;++G;--E;K&&(d=(d<<16)+(d<<1)+d&2147483647)}while(0<=D);m+=h;r-=h;++x;
--y}while(0<--f)},"~A,~N,~N,~N,~N,~A");c(c$,"renderQuadrant",function(a,b,d,c,f,e,h){e=w(e/2);var k=d+e*a,l=(0>d?-1:d<this.width?0:1)+(0>k?-2:k<this.width?0:2);-3==l||3==l||(k=c+e*b,k=(0>c?-1:c<this.height?0:1)+(0>k?-2:k<this.height?0:2),-3==k||3==k||(null==this.mat&&0==l&&0==k&&f-e>=this.slab&&f<=this.depth?this.renderQuadrantUnclipped(e,a,b,f,h):this.renderQuadrantClipped(e,a,b,d,c,f,h)))},"~N,~N,~N,~N,~N,~N,~A");c(c$,"renderQuadrantUnclipped",function(a,b,d,c,f){for(var e=a*a,h=2*a+1,k=0>d?-this.width:
this.width,l=this.offsetPbufBeginLine,j=this.zbuf,m=this.g3d.pixel,r=this.shader.sphereShadeIndexes,x=0,y=0;y<=e;y+=x+ ++x,l+=k)for(var n=l,C=e-y,p=c-a,q=w((x*d+a<<8)/h),s=0,u=0;u<=C;u+=s+ ++s,n+=b)if(!(j[n]<=p)&&(p=w(Math.sqrt(C-u)),p=c-p,!(j[n]<=p))){var t=w((s*b+a<<8)/h);m.addPixel(n,p,f[r[(q<<8)+t]])}},"~N,~N,~N,~N,~A");c(c$,"renderQuadrantClipped",function(a,b,d,c,f,e,h){for(var k=null!=this.mat,l=0<=this.selectedOctant,j=a*a,m=2*a+1,r=0>d?-this.width:this.width,x=this.offsetPbufBeginLine,y=
(c<<16)+(f<<1)^858993459,n=0,C=0,p=this.g3d.pixel,q=0,s=this.height,u=this.width,t=this.zbuf,v=this.dxyz,A=this.slab,B=this.depth,D=this.ptTemp,G=this.coef,E=this.zroot,H=this.selectedOctant,K=this.shader,I=this.planeShades,L=K.sphereShadeIndexes,M=this.planeShade,N=this.mat,O=0,Q=0,P=f;Q<=j;Q+=O+ ++O,x+=r,P+=d)if(0>P){if(0>d)break}else if(P>=s){if(0<d)break}else{var T=j-(k?0:Q);k||(n=w((O*d+a<<8)/m));for(var y=(y<<16)+(y<<1)+y&2147483647,R=c,V=0,W=0,X=-1,Z=1,Y=x;W<=T;W+=V+ ++V,Y+=b,R+=b)if(0>R){if(0>
b)break}else if(R>=u){if(0<b)break}else{var S;if(k){S=(G[4]*R+G[5]*P+G[8])/G[2]/2;var U=S*S-(G[0]*R*R+G[1]*P*P+G[3]*R*P+G[6]*R+G[7]*P-1)/G[2];if(0>U){if(0<=X)break;continue}U=Math.sqrt(U);E[0]=-S-U;E[1]=-S+U;X=e<A?1:0;if(0==(S=w(E[X])))S=e;Z=2;q=S;if(l){D.set(R-c,P-f,S-e);N.rotate(D);U=0;0>D.x&&(U|=1);0>D.y&&(U|=2);0>D.z&&(U|=4);if(U==H){if(0<=M)C=M;else{Z=3;C=3.4028235E38;for(S=0;3>S;S++)if(0!=(U=v[S][2]))U=e+(-v[S][0]*(R-c)-v[S][1]*(P-f))/U,U<C&&(C=U,Z=S);3==Z&&(Z=0,C=e);E[0]=C;C=I[Z]}S=w(E[0]);
Z=3}if(U=e<A?S>=A:S<A)q=S=A,Z=0}if(S<A||S>B||t[Y]<=q)continue}else{S=w(Math.sqrt(T-W));S=e+(e<A?S:-S);if(U=e<A?S>=A:S<A)S=A,Z=0;if(S<A||S>B||t[Y]<=S)continue}switch(Z){case 0:C=44+(y>>8&7);y=(y<<16)+(y<<1)+y&2147483647;Z=1;break;case 2:C=K.getEllipsoidShade(R,P,E[X],a,this.mDeriv);break;case 3:p.clearPixel(Y,q);break;default:C=w((V*b+a<<8)/m),C=L[(n<<8)+C]}p.addPixel(Y,S,h[C])}y=(y+R+P|1)&2147483647}},"~N,~N,~N,~N,~N,~N,~A");E(c$,"maxOddSizeSphere",49,"maxSphereDiameter",1E3,"maxSphereDiameter2",
2E3,"SHADE_SLAB_CLIPPED",47)});s("J.g3d");v(["java.util.Hashtable"],"J.g3d.TextRenderer",["JU.CU"],function(){c$=t(function(){this.size=this.mapWidth=this.width=this.ascent=this.height=0;this.tmap=null;this.isInvalid=!1;p(this,arguments)},J.g3d,"TextRenderer");c$.clearFontCache=c(c$,"clearFontCache",function(){J.g3d.TextRenderer.working||(J.g3d.TextRenderer.htFont3d.clear(),J.g3d.TextRenderer.htFont3dAntialias.clear())});c$.plot=c(c$,"plot",function(a,b,d,c,f,e,h,k,l,j){if(0==e.length)return 0;if(0<=
e.indexOf("<su")||0<=e.indexOf("<color"))return J.g3d.TextRenderer.plotByCharacter(a,b,d,c,f,e,h,k,l,j);var m=h.getAscent();b-=m;e=J.g3d.TextRenderer.getPlotText3D(a,b,k,e,h,j);if(e.isInvalid)return e.width;j&&0==(c&12632256)&&(c|=263172);j=e.height;h=e.width;var m=e.tmap,r=k.width,x=k.height,y=k.zbuf,n=k.pixel,C=k.translucencyLog;if(null!=l||(0>a||a+e.width>r||0>b||b+e.height>x)&&null!=(l=k))for(var p=k=0;p<j;p++)for(var q=0;q<h;q++){var s=m[k++];0!=s&&l.plotImagePixel(c,a+q,b+p,d,s,f,r,x,y,n,C)}else{k=
p=0;for(a=b*r+a;p<j;p++,a+=r-h)for(q=0;q<h;q++)n.addImagePixel(m[k++],C,a++,d,c,f)}return e.width},"~N,~N,~N,~N,~N,~S,JU.Font,J.g3d.Graphics3D,J.api.JmolRendererInterface,~B");c$.plotByCharacter=c(c$,"plotByCharacter",function(a,b,d,c,f,e,h,k,l,j){for(var m=0,r=e.length,x=Math.round(0.25*h.getHeight()),y=-Math.round(0.3*h.getHeight()),n=0,C=0;C<r;C++){if("<"==e.charAt(C)){if(C+5<r&&e.substring(C,C+6).equals("<color")){var n=c,p=e.indexOf(">",C);if(0>p)continue;c=JU.CU.getArgbFromString(e.substring(C+
7,p).trim());C=p;continue}if(C+7<r&&e.substring(C,C+8).equals("</color>")){C+=7;c=n;continue}if(C+4<r&&e.substring(C,C+5).equals("<sub>")){C+=4;b+=x;continue}if(C+4<r&&e.substring(C,C+5).equals("<sup>")){C+=4;b+=y;continue}if(C+5<r&&e.substring(C,C+6).equals("</sub>")){C+=5;b-=x;continue}if(C+5<r&&e.substring(C,C+6).equals("</sup>")){C+=5;b-=y;continue}}p=J.g3d.TextRenderer.plot(a+m,b,d,c,f,e.substring(C,C+1),h,k,l,j);m+=p}return m},"~N,~N,~N,~N,~N,~S,JU.Font,J.g3d.Graphics3D,J.api.JmolRendererInterface,~B");
q(c$,function(a,b){this.ascent=b.getAscent();this.height=b.getHeight();this.width=b.stringWidth(a);0!=this.width&&(this.mapWidth=this.width,this.size=this.mapWidth*this.height)},"~S,JU.Font");c$.getPlotText3D=c(c$,"getPlotText3D",function(a,b,d,c,f,e){J.g3d.TextRenderer.working=!0;e=e?J.g3d.TextRenderer.htFont3dAntialias:J.g3d.TextRenderer.htFont3d;var h=e.get(f),k=null,l=!1,j=!1;null!=h?k=h.get(c):(h=new java.util.Hashtable,l=!0);null==k&&(k=new J.g3d.TextRenderer(c,f),j=!0);k.isInvalid=0==k.width||
0>=a+k.width||a>=d.width||0>=b+k.height||b>=d.height;if(k.isInvalid)return k;l&&e.put(f,h);j&&(k.setTranslucency(c,f,d),h.put(c,k));J.g3d.TextRenderer.working=!1;return k},"~N,~N,J.g3d.Graphics3D,~S,JU.Font,~B");c(c$,"setTranslucency",function(a,b,d){a=d.apiPlatform.getTextPixels(a,b,d.platform.getGraphicsForTextOrImage(this.mapWidth,this.height),d.platform.offscreenImage,this.mapWidth,this.height,this.ascent);if(null!=a){this.tmap=Q(this.size,0);for(b=a.length;0<=--b;)d=a[b]&255,0!=d&&(this.tmap[b]=
J.g3d.TextRenderer.translucency[d>>5])}},"~S,JU.Font,J.g3d.Graphics3D");E(c$,"translucency",Q(-1,[7,6,5,4,3,2,1,8]),"working",!1);c$.htFont3d=c$.prototype.htFont3d=new java.util.Hashtable;c$.htFont3dAntialias=c$.prototype.htFont3dAntialias=new java.util.Hashtable});s("J.g3d");v(["JU.P3i"],"J.g3d.TextString",null,function(){c$=t(function(){this.font=this.text=null;this.bgargb=this.argb=0;p(this,arguments)},J.g3d,"TextString",JU.P3i,java.util.Comparator);c(c$,"setText",function(a,b,d,c,f,e,h){this.text=
a;this.font=b;this.argb=d;this.bgargb=c;this.x=f;this.y=e;this.z=h},"~S,JU.Font,~N,~N,~N,~N,~N");j(c$,"compare",function(a,b){return null==a||null==b?0:a.z>b.z?-1:a.z<b.z?1:0},"J.g3d.TextString,J.g3d.TextString");c(c$,"toString",function(){return V(this,J.g3d.TextString,"toString",[])+" "+this.text})});s("J.g3d");v(["J.g3d.G3DRenderer","$.PrecisionRenderer","JU.Rgb16"],"J.g3d.TriangleRenderer",["JU.GData"],function(){c$=t(function(){this.rgb16t2=this.rgb16t1=this.rgb16sGouraud=this.rgb16sE=this.rgb16sW=
this.azE=this.axE=this.azW=this.axW=this.bb=this.aa=this.az=this.ay=this.ax=this.g3d=null;p(this,arguments)},J.g3d,"TriangleRenderer",J.g3d.PrecisionRenderer,J.g3d.G3DRenderer);O(c$,function(){this.ax=B(3,0);this.ay=B(3,0);this.az=B(3,0);this.aa=K(64,0);this.bb=K(64,0);this.axW=B(64,0);this.azW=B(64,0);this.axE=B(64,0);this.azE=B(64,0);this.rgb16t1=new JU.Rgb16;this.rgb16t2=new JU.Rgb16});q(c$,function(){I(this,J.g3d.TriangleRenderer,[])});j(c$,"set",function(a){try{this.rgb16sW=Array(64);this.rgb16sE=
Array(64);for(var b=64;0<=--b;)this.rgb16sW[b]=new JU.Rgb16,this.rgb16sE[b]=new JU.Rgb16;this.g3d=a;this.rgb16sGouraud=Array(3);for(b=3;0<=--b;)this.rgb16sGouraud[b]=new JU.Rgb16}catch(d){if(!H(d,Exception))throw d;}return this},"J.api.JmolRendererInterface,JU.GData");c(c$,"reallocRgb16s",function(a,b){var d=Array(b);System.arraycopy(a,0,d,0,a.length);for(var c=a.length;c<b;++c)d[c]=new JU.Rgb16;return d},"~A,~N");c(c$,"setGouraud",function(a,b,d){this.rgb16sGouraud[0].setInt(a);this.rgb16sGouraud[1].setInt(b);
this.rgb16sGouraud[2].setInt(d)},"~N,~N,~N");c(c$,"fillTriangle",function(a,b,d,c){this.ax[0]=a.x;this.ax[1]=b.x;this.ax[2]=d.x;this.ay[0]=a.y;this.ay[1]=b.y;this.ay[2]=d.y;this.az[0]=a.z;this.az[1]=b.z;this.az[2]=d.z;if(!(1>=this.az[0]||1>=this.az[1]||1>=this.az[2])){b=this.g3d.clipCode3(this.ax[0],this.ay[0],this.az[0]);d=this.g3d.clipCode3(this.ax[1],this.ay[1],this.az[1]);var f=this.g3d.clipCode3(this.ax[2],this.ay[2],this.az[2]),e=b|d|f;a=0!=e;if(!a||!(-1==e||0!=(b&d&f))){f=0;this.ay[1]<this.ay[f]&&
(f=1);this.ay[2]<this.ay[f]&&(f=2);var e=(f+1)%3,h=(f+2)%3;if(this.ay[e]>this.ay[h])var k=e,e=h,h=k;b=this.ay[f];var l=this.ay[e],j=this.ay[h];d=j-b+1;if(!(d>3*this.g3d.height)){if(d>this.axW.length){var m=d+31&-32;this.axW=B(m,0);this.azW=B(m,0);this.axE=B(m,0);this.azE=B(m,0);this.aa=K(m,0);this.bb=K(m,0);this.rgb16sW=this.reallocRgb16s(this.rgb16sW,m);this.rgb16sE=this.reallocRgb16s(this.rgb16sE,m)}var r;c?(m=this.rgb16sW,r=this.rgb16sE):m=r=null;k=l-b;0==k?(this.ax[e]<this.ax[f]&&(k=e,e=f,f=k),
this.generateRaster(d,f,h,this.axW,this.azW,0,m),this.generateRaster(d,e,h,this.axE,this.azE,0,r)):l==j?(this.ax[h]<this.ax[e]&&(k=e,e=h,h=k),this.generateRaster(d,f,e,this.axW,this.azW,0,m),this.generateRaster(d,f,h,this.axE,this.azE,0,r)):(l=this.ax[h]-this.ax[f],j=JU.GData.roundInt(w(d/2)),0>l&&(j=-j),this.ax[f]+w((l*k+j)/d)<this.ax[e]?(this.generateRaster(d,f,h,this.axW,this.azW,0,m),this.generateRaster(k+1,f,e,this.axE,this.azE,0,r),this.generateRaster(d-k,e,h,this.axE,this.azE,k,r)):(this.generateRaster(k+
1,f,e,this.axW,this.azW,0,m),this.generateRaster(d-k,e,h,this.axW,this.azW,k,m),this.generateRaster(d,f,h,this.axE,this.azE,0,r)));this.g3d.setZMargin(5);f=this.g3d.pass2Flag01;e=1-f;h=0;0>b&&(d+=b,h-=b,b=0);b+d>this.g3d.height&&(d=this.g3d.height-b);if(c)if(a)for(;--d>=f;++b,++h)a=this.axE[h]-(c=this.axW[h])+e,0<a&&this.g3d.plotPixelsClippedRaster(a,c,b,this.azW[h],this.azE[h],this.rgb16sW[h],this.rgb16sE[h]);else for(;--d>=f;++b,++h)a=this.axE[h]-(c=this.axW[h])+e,1==f&&0>a&&(a=1,c--),0<a&&this.g3d.plotPixelsUnclippedRaster(a,
c,b,this.azW[h],this.azE[h],this.rgb16sW[h],this.rgb16sE[h]);else if(a)for(;--d>=f;++b,++h)a=this.axE[h]-(c=this.axW[h])+e,0<a&&this.g3d.plotPixelsClippedRasterBits(a,c,b,this.azW[h],this.azE[h],null,null,this.aa[h],this.bb[h]);else for(;--d>=f;++b,++h)a=this.axE[h]-(c=this.axW[h])+e,1==f&&0>a&&(a=1,c--),0<a&&this.g3d.plotPixelsUnclippedRasterBits(a,c,b,null,null,this.aa[h],this.bb[h]);this.g3d.setZMargin(0)}}}},"JU.P3i,JU.P3i,JU.P3i,~B");c(c$,"generateRaster",function(a,b,d,c,f,e,h){var k=this.ax[b],
l=this.ax[d]-k,j,m,r;0<=l?(j=1,m=l,r=0):(j=-1,m=-l,r=1-a);var x;m<=a?x=0:(x=JU.GData.roundInt(w(l/a)),m%=a);this.setRastAB(this.ay[b],this.az[b],this.ay[d],this.az[d]);for(var y=this.a,n=this.b,C=c===this.axE,p=0,q=this.ay[b],s=a-1,l=e;p<=s;++l,++p,++q){if(0==l||l>e)c[l]=p==s?this.ax[d]:k,f[l]=this.getZCurrent(y,n,q),C&&(this.setRastAB(this.axW[l],this.azW[l],c[l],f[l]),this.aa[l]=this.a,this.bb[l]=this.b);k+=x;r+=m;0<r&&(k+=j,r-=a)}if(null!=h){c=this.rgb16t1;c.setRgb(this.rgb16sGouraud[b]);b=this.rgb16t2;
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2*b/10)));break;default:d?d=A(this.vwr.tm.scaleToScreen(a,w(b/10))):(this.g3d.isAntialiased()&&(b+=b),d=b)}return d},"~N,~N");c(c$,"renderLine",function(a,b,d,c){0>d?this.g3d.drawDashedLineBits(8,4,a,b):this.g3d.fillCylinderBits(this.endcap,d,a,b);c&&null!=this.tickInfo&&(this.checkTickTemps(),this.tickAs.setT(a),this.tickBs.setT(b),this.drawTicks(d,!0))},"JU.P3,JU.P3,~N,~B");c(c$,"checkTickTemps",function(){null==this.tickA&&(this.tickA=new JU.P3,this.tickB=new JU.P3,this.tickAs=new JU.P3,this.tickBs=
new JU.P3)});c(c$,"drawTicks",function(a,b){Float.isNaN(this.tickInfo.first)&&(this.tickInfo.first=0);this.drawTicks2(this.tickInfo.ticks.x,8,a,!b?null:null==this.tickInfo.tickLabelFormats?u(-1,["%0.2f"]):this.tickInfo.tickLabelFormats);this.drawTicks2(this.tickInfo.ticks.y,4,a,null);this.drawTicks2(this.tickInfo.ticks.z,2,a,null)},"~N,~B");c(c$,"drawTicks2",function(a,b,d,c){if(0!=a&&(this.g3d.isAntialiased()&&(b*=2),this.vectorT2.set(this.tickBs.x,this.tickBs.y,0),this.vectorT.set(this.tickAs.x,
this.tickAs.y,0),this.vectorT2.sub(this.vectorT),!(50>this.vectorT2.length()))){var f=this.tickInfo.signFactor;this.vectorT.sub2(this.tickB,this.tickA);var e=this.vectorT.length();if(null!=this.tickInfo.scale)if(Float.isNaN(this.tickInfo.scale.x)){var h=this.vwr.getUnitCellInfo(0);Float.isNaN(h)||this.vectorT.set(this.vectorT.x/h,this.vectorT.y/this.vwr.getUnitCellInfo(1),this.vectorT.z/this.vwr.getUnitCellInfo(2))}else this.vectorT.set(this.vectorT.x*this.tickInfo.scale.x,this.vectorT.y*this.tickInfo.scale.y,
this.vectorT.z*this.tickInfo.scale.z);h=this.vectorT.length()+1E-4*a;if(!(h<a)){this.vectorT.scale(a/h*e/h);var e=(this.tickBs.z-this.tickAs.z)/(h/a),h=h+this.tickInfo.first,k=w(Math.floor(this.tickInfo.first/a))*a-this.tickInfo.first;this.pointT.scaleAdd2(k/a,this.vectorT,this.tickA);var k=k+this.tickInfo.first,l=this.tickAs.z;0>d&&(d=1);this.vectorT2.set(-this.vectorT2.y,this.vectorT2.x,0);this.vectorT2.scale(b/this.vectorT2.length());b=this.tickInfo.reference;null==b?(this.pointT3.setT(this.vwr.getBoundBoxCenter()),
603979809==this.vwr.g.axesMode&&this.pointT3.add3(1,1,1)):this.pointT3.setT(b);this.tm.transformPtScr(this.pointT3,this.pt2i);b=0.2>Math.abs(this.vectorT2.x/this.vectorT2.y);for(var j=!b,m=!b&&0>this.vectorT2.x,r=null!=c&&0<c.length,x,y,n=Array(1),C=this.draw000?0:-1;k<h;){if(k>=this.tickInfo.first&&(this.pointT2.setT(this.pointT),this.tm.transformPt3f(this.pointT2,this.pointT2),this.drawLine(w(Math.floor(this.pointT2.x)),w(Math.floor(this.pointT2.y)),A(l),x=w(Math.floor(this.pointT2.x+this.vectorT2.x)),
y=w(Math.floor(this.pointT2.y+this.vectorT2.y)),A(l),d),r&&(this.draw000||0!=k))){n[0]=Float.$valueOf(0==k?0:k*f);var p=JU.PT.sprintf(c[C%c.length],"f",n);this.drawString(x,y,A(l),4,m,b,j,w(Math.floor(this.pointT2.y)),p)}this.pointT.add(this.vectorT);k+=a;l+=e;C++}}}},"~N,~N,~N,~A");c(c$,"drawLine",function(a,b,d,c,f,e,h){return this.drawLine2(a,b,d,c,f,e,h)},"~N,~N,~N,~N,~N,~N,~N");c(c$,"drawLine2",function(a,b,d,c,f,e,h){this.pt0.set(a,b,d);this.pt1.set(c,f,e);if(this.dotsOrDashes)null!=this.dashDots&&
this.drawDashed(a,b,d,c,f,e,this.dashDots);else{if(0>h)return this.g3d.drawDashedLineBits(8,4,this.pt0,this.pt1),1;this.g3d.fillCylinderBits(2,h,this.pt0,this.pt1)}return w((h+1)/2)},"~N,~N,~N,~N,~N,~N,~N");c(c$,"drawString",function(a,b,d,c,f,e,h,k,l){if(null!=l){var j=this.font3d.stringWidth(l),m=this.font3d.getAscent();a=f?a-(w(c/2)+2+j):e?a-(w(c/2)+2+w(j/2)):a+(w(c/2)+2);f=b;f=h?f+w(m/2):0==k||k<b?f+m:f-w(c/2);b=d-c-2;1>b&&(b=1);this.g3d.drawString(l,this.font3d,a,f,b,b,0)}},"~N,~N,~N,~N,~B,~B,~B,~N,~S");
c(c$,"drawDashed",function(a,b,d,c,f,e,h){if(!(null==h||0>this.width)){var k=h[0];c-=a;f-=b;e-=d;var l=0,j=h===J.render.FontLineShapeRenderer.ndots,m=j||h===J.render.FontLineShapeRenderer.sixdots;if(m){var r=(c*c+f*f)/(this.width*this.width);j?(k=Math.sqrt(r)/1.5,l=A(k)+2):8>r?h=J.render.FontLineShapeRenderer.twodots:32>r&&(h=J.render.FontLineShapeRenderer.fourdots)}var r=h[1],x=h[2],y=this.colixA,n=0==x?this.colixB:this.colixA;0==l&&(l=h.length);for(var C=0,p=3;p<l;p++){var C=j?C+1:h[p],q=w(Math.floor(a+
c*C/k)),s=w(Math.floor(b+f*C/k)),u=w(Math.floor(d+e*C/k));if(m)this.s1.set(q,s,u),p==r?this.g3d.setC(this.colixA):p==x&&this.g3d.setC(this.colixB),this.g3d.fillSphereI(this.width,this.s1);else{p==r&&(y=this.colixB);C=h[++p];p==x&&(n=this.colixB);var t=w(Math.floor(a+c*C/k)),v=w(Math.floor(b+f*C/k)),B=w(Math.floor(d+e*C/k));this.fillCylinder(y,n,2,this.width,q,s,u,t,v,B)}}}},"~N,~N,~N,~N,~N,~N,~A");c(c$,"fillCylinder",function(a,b,d,c,f,e,h,k,l,j){this.asLineOnly?this.g3d.drawLine(a,b,f,e,h,k,l,j):
this.g3d.fillCylinderXYZ(a,b,d,!this.isExport||1==this.mad?c:this.mad,f,e,h,k,l,j)},"~N,~N,~N,~N,~N,~N,~N,~N,~N,~N");E(c$,"dashes",B(-1,[12,0,0,2,5,7,10]),"hDashes",B(-1,[10,7,6,1,3,4,6,7,9]),"ndots",B(-1,[0,3,1E3]),"sixdots",B(-1,[12,3,6,1,3,5,7,9,11]),"fourdots",B(-1,[13,3,5,2,5,8,11]),"twodots",B(-1,[12,3,4,3,9]))});s("J.render");v(["J.render.ShapeRenderer"],"J.render.FrankRenderer",["JV.Viewer"],function(){c$=D(J.render,"FrankRenderer",J.render.ShapeRenderer);j(c$,"render",function(){var a=this.shape,
b=this.vwr.getBooleanProperty("allowKeyStrokes"),d=this.vwr.getBoolean(603983903);this.colix=d?20:this.vwr.isSignedApplet?b||(JV.Viewer.isJS||JV.Viewer.isSwingJS)&&!this.vwr.isWebGL?5:10:b?7:12;if(this.isExport||!this.vwr.getShowFrank()||!this.g3d.setC(this.colix))return!1;if(this.vwr.frankOn&&!this.vwr.noFrankEcho)return this.vwr.noFrankEcho;this.vwr.noFrankEcho=!0;b=this.vwr.imageFontScaling;a.getFont(b);b=A(a.frankWidth+4*b);this.g3d.drawStringNoSlab(a.frankString,a.font3d,this.vwr.gdata.width-
b,this.vwr.gdata.height-a.frankDescent,0,0);a=d?this.vwr.getModelkit(!1):null;d&&!a.isHidden()&&(this.g3d.setC(12),this.g3d.fillTextRect(0,0,1,0,10,104),d=a.getActiveMenu(),null!=d&&("atomMenu".equals(d)?(this.g3d.setC(21),this.g3d.fillTextRect(0,0,0,0,10,26)):"bondMenu".equals(d)?(this.g3d.setC(7),this.g3d.fillTextRect(0,26,0,0,10,26)):"xtalMenu".equals(d)&&(this.g3d.setC(8),this.g3d.fillTextRect(0,52,0,0,10,26))));return!1})});s("J.render");v(["J.api.JmolRepaintManager","JU.BS"],"J.render.RepaintManager",
"java.lang.NullPointerException $.Thread J.api.Interface JU.Logger JV.JC $.Viewer".split(" "),function(){c$=t(function(){this.bsTranslucent=this.renderers=this.shapeManager=this.vwr=null;this.holdRepaint=0;this.repaintPending=!1;p(this,arguments)},J.render,"RepaintManager",null,J.api.JmolRepaintManager);O(c$,function(){this.bsTranslucent=JU.BS.newN(37)});q(c$,function(){});j(c$,"set",function(a,b){this.vwr=a;this.shapeManager=b},"JV.Viewer,JV.ShapeManager");j(c$,"isRepaintPending",function(){return this.repaintPending});
j(c$,"pushHoldRepaint",function(){++this.holdRepaint},"~S");j(c$,"popHoldRepaint",function(a,b){--this.holdRepaint;0>=this.holdRepaint&&(this.holdRepaint=0,a&&(this.repaintPending=!0,this.repaintNow(b)))},"~B,~S");j(c$,"requestRepaintAndWait",function(a){var b=null;JV.Viewer.isJS&&!JV.Viewer.isSwingJS&&(b=self.Jmol&&Jmol.repaint?Jmol:null);if(null==b)try{this.repaintNow(a),JV.Viewer.isJS||this.wait(this.vwr.g.repaintWaitMs),this.repaintPending&&(JU.Logger.error("repaintManager requestRepaintAndWait timeout"),
this.repaintDone())}catch(d){if(H(d,InterruptedException))System.out.println("repaintManager requestRepaintAndWait interrupted thread="+Thread.currentThread().getName());else throw d;}else b.repaint(this.vwr.html5Applet,!1),this.repaintDone()},"~S");j(c$,"repaintIfReady",function(a){if(this.repaintPending)return!1;this.repaintPending=!0;0==this.holdRepaint&&this.repaintNow(a);return!0},"~S");c(c$,"repaintNow",function(){this.vwr.haveDisplay&&this.vwr.apiPlatform.repaint(this.vwr.display)},"~S");j(c$,
"repaintDone",function(){this.repaintPending=!1});j(c$,"clear",function(a){if(null!=this.renderers)if(0<=a)this.renderers[a]=null;else for(a=0;37>a;++a)this.renderers[a]=null},"~N");c(c$,"getRenderer",function(a){if(null!=this.renderers[a])return this.renderers[a];var b=JV.JC.getShapeClassName(a,!0)+"Renderer";if(null==(b=J.api.Interface.getInterface(b,this.vwr,"render")))return null;b.setViewerG3dShapeID(this.vwr,a);return this.renderers[a]=b},"~N");j(c$,"render",function(a,b,d,c){null==this.renderers&&
(this.renderers=Array(37));this.getAllRenderers();try{var f=this.vwr.getBoolean(603979934);a.renderBackground(null);if(d){this.bsTranslucent.clearAll();null!=c&&a.renderCrossHairs(c,this.vwr.getScreenWidth(),this.vwr.getScreenHeight(),this.vwr.tm.getNavigationOffset(),this.vwr.tm.navigationDepthPercent);var e=this.vwr.getRubberBandSelection();null!=e&&a.setC(this.vwr.cm.colixRubberband)&&a.drawRect(e.x,e.y,0,0,e.width,e.height);this.vwr.noFrankEcho=!0}c=null;for(e=0;37>e&&a.currentlyRendering;++e){var h=
this.shapeManager.getShape(e);null!=h&&(f&&(c="rendering "+JV.JC.getShapeClassName(e,!1),JU.Logger.startTimer(c)),(d||this.bsTranslucent.get(e))&&this.getRenderer(e).renderShape(a,b,h)&&this.bsTranslucent.set(e),f&&JU.Logger.checkTimer(c,!1))}a.renderAllStrings(null)}catch(k){if(H(k,Exception)){k.printStackTrace();if(this.vwr.async&&"Interface".equals(k.getMessage()))throw new NullPointerException;JU.Logger.error("rendering error? "+k)}else throw k;}},"JU.GData,JM.ModelSet,~B,~A");c(c$,"getAllRenderers",
function(){for(var a=!0,b=0;37>b;++b)null==this.shapeManager.getShape(b)||null!=this.getRenderer(b)||(a=this.repaintPending=!this.vwr.async);if(!a)throw new NullPointerException;});j(c$,"renderExport",function(a,b,d){this.shapeManager.finalizeAtoms(null,!0);a=this.vwr.initializeExporter(d);if(null==a)return JU.Logger.error("Cannot export "+d.get("type")),null;null==this.renderers&&(this.renderers=Array(37));this.getAllRenderers();d=null;try{var c=this.vwr.getBoolean(603979934);a.renderBackground(a);
for(var f=0;37>f;++f){var e=this.shapeManager.getShape(f);null!=e&&(c&&(d="rendering "+JV.JC.getShapeClassName(f,!1),JU.Logger.startTimer(d)),this.getRenderer(f).renderShape(a,b,e),c&&JU.Logger.checkTimer(d,!1))}a.renderAllStrings(a);d=a.finalizeOutput()}catch(h){if(H(h,Exception))h.printStackTrace(),JU.Logger.error("rendering error? "+h);else throw h;}return d},"JU.GData,JM.ModelSet,java.util.Map")});s("J.render");v(null,"J.render.ShapeRenderer",["JV.JC"],function(){c$=t(function(){this.shape=this.ms=
this.g3d=this.tm=this.vwr=null;this.exportType=this.mad=this.colix=this.shapeID=this.myVisibilityFlag=0;this.isExport=!1;p(this,arguments)},J.render,"ShapeRenderer");c(c$,"initRenderer",function(){});c(c$,"setViewerG3dShapeID",function(a,b){this.vwr=a;this.tm=a.tm;this.shapeID=b;this.myVisibilityFlag=JV.JC.getShapeVisibilityFlag(b);this.initRenderer()},"JV.Viewer,~N");c(c$,"renderShape",function(a,b,d){this.setup(a,b,d);a=this.render();this.exportType=0;this.isExport=!1;return a},"J.api.JmolRendererInterface,JM.ModelSet,J.shape.Shape");
c(c$,"setup",function(a,b,d){this.g3d=a;this.ms=b;this.shape=d;this.exportType=a.getExportType();this.isExport=0!=this.exportType},"J.api.JmolRendererInterface,JM.ModelSet,J.shape.Shape");c(c$,"isVisibleForMe",function(a){return a.isVisible(this.myVisibilityFlag|9)},"JM.Atom")});s("J.render");v(["J.render.FontLineShapeRenderer","JU.BS","$.P3","$.V3"],"J.render.SticksRenderer","java.lang.Float JU.A4 $.M3 J.c.PAL JU.C $.Edge".split(" "),function(){c$=t(function(){this.showMultipleBonds=!1;this.multipleBondRadiusFactor=
this.multipleBondSpacing=0;this.useBananas=this.bondsPerp=!1;this.modeMultipleBond=0;this.isCartesian=!1;this.endcaps=0;this.hbondsSolid=this.bondsBackbone=this.hbondsBackbone=this.ssbondsBackbone=!1;this.bond=this.b=this.a=null;this.bondOrder=this.mag2d=this.dy=this.dx=this.zB=this.yB=this.xB=this.zA=this.yA=this.xA=0;this.slabByAtom=this.slabbing=this.isAntialiased=this.wireframeOnly=!1;this.bsForPass2=this.p2=this.p1=this.z=this.y=this.x=null;this.isPass2=!1;this.dyStep=this.dxStep=this.yAxis2=
this.xAxis2=this.yAxis1=this.xAxis1=this.rTheta=0;this.a4=this.rot=null;p(this,arguments)},J.render,"SticksRenderer",J.render.FontLineShapeRenderer);O(c$,function(){this.x=new JU.V3;this.y=new JU.V3;this.z=new JU.V3;this.p1=new JU.P3;this.p2=new JU.P3;this.bsForPass2=JU.BS.newN(64)});j(c$,"render",function(){var a=this.ms.bo;if(null==a)return!1;(this.isPass2=this.vwr.gdata.isPass2)||this.bsForPass2.clearAll();this.slabbing=this.tm.slabEnabled;this.slabByAtom=this.vwr.getBoolean(603979939);this.endcaps=
3;this.dashDots=this.vwr.getBoolean(603979893)?J.render.FontLineShapeRenderer.sixdots:J.render.FontLineShapeRenderer.dashes;this.isCartesian=1==this.exportType;this.getMultipleBondSettings(!1);this.wireframeOnly=!this.vwr.checkMotionRendering(1677721602);this.ssbondsBackbone=this.vwr.getBoolean(603979952);this.hbondsBackbone=this.vwr.getBoolean(603979852);this.bondsBackbone=(new Boolean(this.hbondsBackbone|this.ssbondsBackbone)).valueOf();this.hbondsSolid=this.vwr.getBoolean(603979854);this.isAntialiased=
this.g3d.isAntialiased();var b=!1;if(this.isPass2){if(!this.isExport)for(var d=this.bsForPass2.nextSetBit(0);0<=d;d=this.bsForPass2.nextSetBit(d+1))this.bond=a[d],this.renderBond()}else for(d=this.ms.bondCount;0<=--d;)this.bond=a[d],0!=(this.bond.shapeVisibilityFlags&this.myVisibilityFlag)&&this.renderBond()&&(b=!0,this.bsForPass2.set(d));return b});c(c$,"getMultipleBondSettings",function(a){this.useBananas=this.vwr.getBoolean(603979886)&&!a;this.multipleBondSpacing=a?0.15:this.vwr.getFloat(570425370);
this.multipleBondRadiusFactor=a?0.4:this.vwr.getFloat(570425369);this.bondsPerp=this.useBananas||0<this.multipleBondSpacing&&0>this.multipleBondRadiusFactor;this.useBananas&&(this.multipleBondSpacing=0>this.multipleBondSpacing?0.4*-this.multipleBondSpacing:this.multipleBondSpacing);this.multipleBondRadiusFactor=Math.abs(this.multipleBondRadiusFactor);0==this.multipleBondSpacing&&this.isCartesian&&(this.multipleBondSpacing=0.2);this.modeMultipleBond=this.vwr.g.modeMultipleBond;this.showMultipleBonds=
0!=this.multipleBondSpacing&&0!=this.modeMultipleBond&&this.vwr.getBoolean(603979928)},"~B");c(c$,"renderBond",function(){var a,b;this.a=a=this.bond.atom1;this.b=b=this.bond.atom2;var d=this.bond.order&-131073;this.bondsBackbone&&(this.ssbondsBackbone&&0!=(d&256)?(this.a=this.a.group.getLeadAtomOr(this.a),this.b=this.b.group.getLeadAtomOr(this.b)):this.hbondsBackbone&&JU.Edge.isOrderH(d)&&(this.a=this.a.group.getLeadAtomOr(this.a),this.b=this.b.group.getLeadAtomOr(this.b)));if(!this.isPass2&&(!this.a.isVisible(9)||
!this.b.isVisible(9)||!this.g3d.isInDisplayRange(this.a.sX,this.a.sY)||!this.g3d.isInDisplayRange(this.b.sX,this.b.sY)))return!1;if(this.slabbing){var c=this.vwr.gdata.isClippedZ(this.a.sZ);if(c&&this.vwr.gdata.isClippedZ(this.b.sZ)||this.slabByAtom&&(c||this.vwr.gdata.isClippedZ(this.b.sZ)))return!1}this.zA=this.a.sZ;this.zB=this.b.sZ;if(1==this.zA||1==this.zB)return!1;this.colixA=a.colixAtom;this.colixB=b.colixAtom;2==((this.colix=this.bond.colix)&-30721)?(this.colix&=30720,this.colixA=JU.C.getColixInherited(this.colix|
this.vwr.cm.getColixAtomPalette(a,J.c.PAL.CPK.id),this.colixA),this.colixB=JU.C.getColixInherited(this.colix|this.vwr.cm.getColixAtomPalette(b,J.c.PAL.CPK.id),this.colixB)):(this.colixA=JU.C.getColixInherited(this.colix,this.colixA),this.colixB=JU.C.getColixInherited(this.colix,this.colixB));a=!1;if(!this.isExport&&!this.isPass2&&(b=!JU.C.renderPass2(this.colixA),c=!JU.C.renderPass2(this.colixB),!b||!c)){if(!b&&!c&&!a)return this.g3d.setC(!b?this.colixA:this.colixB),!0;a=!0}this.bondOrder=d&-131073;
if(0==(this.bondOrder&224)&&(0!=(this.bondOrder&256)&&(this.bondOrder&=-257),0!=(this.bondOrder&1023)&&(!this.showMultipleBonds||2==this.modeMultipleBond&&500<this.mad||65536==(this.bondOrder&98304))))this.bondOrder=1;b=0;switch(this.bondOrder){case 1025:case 1041:this.bondOrder=1;case 1:case 2:case 3:case 4:case 5:case 6:break;case 17:case 513:this.bondOrder=1;b=513==d?0:1;break;case 515:case 514:this.bondOrder=2;b=515==d?this.getAromaticDottedBondMask():0;break;default:0!=(this.bondOrder&224)?(this.bondOrder=
JU.Edge.getPartialBondOrder(d),b=JU.Edge.getPartialBondDotted(d)):JU.Edge.isOrderH(this.bondOrder)?(this.bondOrder=1,this.hbondsSolid||(b=-1)):32768==this.bondOrder?this.bondOrder=1:98304==(this.bondOrder&98304)&&(this.getMultipleBondSettings(!0),this.bondOrder&=3,b=-2)}this.xA=this.a.sX;this.yA=this.a.sY;this.xB=this.b.sX;this.yB=this.b.sY;this.mad=this.bond.mad;0<this.multipleBondRadiusFactor&&1<this.bondOrder&&(this.mad*=this.multipleBondRadiusFactor);this.dx=this.xB-this.xA;this.dy=this.yB-this.yA;
this.width=A(this.vwr.tm.scaleToScreen(w((this.zA+this.zB)/2),this.mad));this.wireframeOnly&&0<this.width&&(this.width=1);if(!this.isCartesian&&(this.asLineOnly=1>=this.width)&&this.isAntialiased)this.width=3,this.asLineOnly=!1;switch(b){case -2:this.drawBond(0);this.getMultipleBondSettings(!1);break;case -1:this.drawDashed(this.xA,this.yA,this.zA,this.xB,this.yB,this.zB,J.render.FontLineShapeRenderer.hDashes);break;default:switch(this.bondOrder){case 4:this.bondOrder=2;d=this.multipleBondRadiusFactor;
0==d&&1<this.width&&(this.width=w(0.5*this.width));d=this.multipleBondSpacing;0>d&&(this.multipleBondSpacing=0.3);this.drawBond(b);this.bondsPerp=!this.bondsPerp;this.bondOrder=2;this.drawBond(b>>2);this.bondsPerp=!this.bondsPerp;this.multipleBondSpacing=d;break;case 5:this.bondOrder=3;d=this.multipleBondRadiusFactor;0==d&&1<this.width&&(this.width=w(0.5*this.width));d=this.multipleBondSpacing;0>d&&(this.multipleBondSpacing=0.2);this.drawBond(b);this.bondsPerp=!this.bondsPerp;this.bondOrder=2;this.multipleBondSpacing*=
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0!=(a&1);if(this.isCartesian&&1==this.bondOrder&&!b)this.g3d.drawBond(this.a,this.b,this.colixA,this.colixB,this.endcaps,this.mad,-1);else{var d=0==this.dx&&0==this.dy;if(!d||!this.asLineOnly||this.isCartesian){var c=1<this.bondOrder&&0<this.multipleBondSpacing,f=c&&(null!=this.vwr.getHybridizationAndAxes(this.a.i,this.z,this.x,"pz")||null!=this.vwr.getHybridizationAndAxes(this.b.i,this.z,this.x,"pz"))&&!Float.isNaN(this.x.x);if(d&&!c){a=w(this.width/8)+3;a=this.width+a;b=this.yA-w((this.bondOrder-
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this.s2.x,this.s2.y,this.s2.z));a>>=1;b=0!=(a&1);if(0>=--this.bondOrder)break;this.p1.add(this.y);this.p2.add(this.y);this.stepAxisCoordinates()}}else if(this.mag2d=Math.round(Math.sqrt(this.dx*this.dx+this.dy*this.dy)),this.resetAxisCoordinates(),this.isCartesian&&3==this.bondOrder)this.fillCylinder(this.colixA,this.colixB,this.endcaps,this.width,this.xAxis1,this.yAxis1,this.zA,this.xAxis2,this.yAxis2,this.zB),this.stepAxisCoordinates(),this.x.sub2(this.b,this.a),this.x.scale(0.05),this.p1.sub2(this.a,
this.x),this.p2.add2(this.b,this.x),this.g3d.drawBond(this.p1,this.p2,this.colixA,this.colixB,this.endcaps,this.mad,-2),this.stepAxisCoordinates(),this.fillCylinder(this.colixA,this.colixB,this.endcaps,this.width,this.xAxis1,this.yAxis1,this.zA,this.xAxis2,this.yAxis2,this.zB);else for(;;){0!=(a&1)?this.drawDashed(this.xAxis1,this.yAxis1,this.zA,this.xAxis2,this.yAxis2,this.zB,this.dashDots):this.fillCylinder(this.colixA,this.colixB,this.endcaps,this.width,this.xAxis1,this.yAxis1,this.zA,this.xAxis2,
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function(){c$=t(function(){this.altloc="\x00";this.atomSite=this.atomID=0;this.group=null;this.atomicAndIsotopeNumber=this.valence=this.userDefinedVanDerWaalRadius=0;this.atomSymmetry=null;this.paletteID=this.colixAtom=this.madAtom=this.formalChargeAndFlags=0;this.bonds=null;this.shapeVisibilityFlags=this.clickabilityFlags=this.nBackbonesDisplayed=this.nBondsDisplayed=0;p(this,arguments)},JM,"Atom",JU.Point3fi,JU.Node);O(c$,function(){this.paletteID=J.c.PAL.CPK.id});j(c$,"setAtom",function(a,b,d,
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break;case J.c.VDW.ADPMIN:case J.c.VDW.ADPMAX:c=this.getADPMinMax(b.vdwType===J.c.VDW.ADPMAX);break;default:c=this.getVanderwaalsRadiusFloat(a,b.vdwType)}d=b.factorType===J.atomdata.RadiusData.EnumType.FACTOR?d*c:d+c;break;case J.atomdata.RadiusData.EnumType.ABSOLUTE:if(16.1==d)return JM.Atom.MAD_GLOBAL}c=$(0>d?d:2E3*d);0>c&&0<d&&(c=0);return c},"JV.Viewer,J.atomdata.RadiusData");c(c$,"getADPMinMax",function(a){var b=this.getTensors();if(null==b)return 0;var d=b[0];if(null==d||1!=d.iType)return 0;
this.group.chain.model.ms.isModulated(this.i)&&d.isUnmodulated&&(d=b[1]);return d.getFactoredValue(a?2:1)},"~B");c(c$,"getTensors",function(){return this.group.chain.model.ms.getAtomTensorList(this.i)});c(c$,"getRasMolRadius",function(){return Math.abs(w(this.madAtom/8))});j(c$,"getEdges",function(){return null==this.bonds?[]:this.bonds});j(c$,"getBondCount",function(){return null==this.bonds?0:this.bonds.length});c(c$,"setTranslucent",function(a,b){this.colixAtom=JU.C.getColixTranslucent3(this.colixAtom,
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this.atomicAndIsotopeNumber:this.atomicAndIsotopeNumber&127)},"~B");c(c$,"getElementSymbol",function(){return this.getElementSymbolIso(!0)});c(c$,"isHetero",function(){return 0!=(this.formalChargeAndFlags&2)});c(c$,"hasVibration",function(){return 0!=(this.formalChargeAndFlags&1)});c(c$,"setFormalCharge",function(a){this.formalChargeAndFlags=this.formalChargeAndFlags&15|(-2147483648==a?0:7<a?7:-3>a?-3:a)<<24},"~N");c(c$,"setVibrationVector",function(){this.formalChargeAndFlags|=1});j(c$,"getFormalCharge",
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"~N,~N,~B");c(c$,"setFractionalCoordTo",function(a,b){this.setFractionalCoordPt(this,a,b)},"JU.P3,~B");c(c$,"setFractionalCoordPt",function(a,b,d){a.setT(b);b=this.getUnitCell();null!=b&&b.toCartesian(a,d&&!this.group.chain.model.isJmolDataFrame)},"JU.P3,JU.P3,~B");c(c$,"isCursorOnTopOf",function(a,b,d,c){var f=w(this.sD/2);f<d&&(f=d);d=f*f;f=this.sX-a;f*=f;if(f>d)return!1;var e=this.sY-b;d-=f+e*e;if(0>d)return!1;if(null==c)return!0;var f=this.sZ,e=c.sZ,h=w(c.sD/2);if(f<e-h)return!0;a=c.sX-a;b=c.sY-
b;b=h*h-(a*a+b*b);return f-Math.sqrt(d)<e-Math.sqrt(b)},"~N,~N,~N,JM.Atom");c(c$,"getInfo",function(){return this.getIdentity(!0)});c(c$,"getIdentityXYZ",function(a,b){b=this.group.chain.model.isJmolDataFrame?this.getFractionalCoordPt(!this.group.chain.model.ms.vwr.g.legacyJavaFloat,!1,b):this;return this.getIdentity(a)+" "+JU.PT.formatF(b.x,0,3,!0,!0)+" "+JU.PT.formatF(b.y,0,3,!0,!0)+" "+JU.PT.formatF(b.z,0,3,!0,!0)},"~B,JU.P3");c(c$,"getIdentity",function(a){var b=new JU.SB,d=this.getGroup3(!0);
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1<this.group.chain.model.ms.mc&&!this.group.chain.model.isJmolDataFrame&&(b.append("/"),b.append(this.getModelNumberForLabel()));b.append(" #");b.appendI(this.getAtomNumber());return b.toString()},"~B");j(c$,"getGroup3",function(a){var b=this.group.getGroup3();return a||null!=b&&0<b.length?b:"UNK"},"~B");j(c$,"getGroup1",function(a){var b=this.group.getGroup1();return"\x00"!=b?""+b:"\x00"!=a?""+a:""},"~S");j(c$,"getBioSmilesType",function(){return this.group.isProtein()?"p":this.group.isDna()?"d":
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j(c$,"getChainID",function(){return this.group.chain.chainID});j(c$,"getChainIDStr",function(){return this.group.chain.getIDStr()});c(c$,"getSurfaceDistance100",function(){return this.group.chain.model.ms.getSurfaceDistance100(this.i)});c(c$,"getVibrationVector",function(){return this.group.chain.model.ms.getVibration(this.i,!1)});c(c$,"getModulation",function(){return this.group.chain.model.ms.getModulation(this.i)});c(c$,"getModelNumberForLabel",function(){return this.group.chain.model.ms.getModelNumberForAtomLabel(this.mi)});
c(c$,"getModelNumber",function(){return this.group.chain.model.ms.getModelNumber(this.mi)%1E6});j(c$,"getBioStructureTypeName",function(){return this.group.getProteinStructureType().getBioStructureTypeName(!0)});j(c$,"equals",function(a){return this===a},"~O");j(c$,"hashCode",function(){return this.i});c(c$,"findAromaticNeighbor",function(a){if(null==this.bonds)return null;for(var b=this.bonds.length;0<=--b;){var d=this.bonds[b],c=d.getOtherAtom(this);if(d.isAromatic()&&c.i!=a)return c}return null},
"~N");c(c$,"atomPropertyInt",function(a){switch(a){case 1094715393:return this.getAtomNumber();case 1094713365:return this.getSeqID();case 1094713346:return this.atomID;case 1094713368:return Math.max(0,this.altloc.charCodeAt(0)-32);case 1094713347:return this.i;case 1228931587:return this.getCovalentBondCount();case 1094713351:return this.group.chain.chainNo;case 1765808134:return this.group.chain.model.ms.vwr.gdata.getColorArgbOrGray(this.colixAtom);case 1086326789:case 1094715402:return this.getElementNumber();
case 1094713353:return this.atomicAndIsotopeNumber;case 1228935687:return this.group.chain.model.fileIndex+1;case 1631586315:return this.getFormalCharge();case 1094713356:return this.group.groupID;case 1094713357:return this.group.groupIndex;case 1094717454:return this.getModelNumber();case -1094717454:return this.group.chain.model.ms.modelFileNumbers[this.mi];case 1094713359:return this.mi;case 1094713360:return this.getMoleculeNumber(!0);case 1094713361:return this.group.getMonomerIndex()+1;case 1128269825:return this.getOccupancy100();
case 1094713362:return this.group.getBioPolymerIndexInModel()+1;case 1094713363:return this.group.getBioPolymerLength();case 1665140738:return this.getRasMolRadius();case 1094715412:return this.getResno();case 1094713366:return this.getAtomSite();case 1639976963:return this.group.getProteinStructureType().getId();case 1237320707:return this.group.getProteinStructureSubType().getId();case 1094713367:return this.group.getStrucNo();case 1296041986:return this.getSymOp();case 1094715417:return this.getValence()}return 0},
"~N");c(c$,"getSymOp",function(){return null==this.atomSymmetry?0:this.atomSymmetry.nextSetBit(0)+1});c(c$,"atomPropertyFloat",function(a,b,d){switch(b){case 1111490561:return this.getADPMinMax(!0);case 1111490562:return this.getADPMinMax(!1);case 1111492609:case 1111492629:return this.x;case 1111492610:case 1111492630:return this.y;case 1111492611:case 1111492631:return this.z;case 1111490587:return this.group.chain.model.ms.getAtomicDSSRData(this.i);case 1114249217:case 1112152066:case 1112150019:case 1112150020:case 1112150021:case 1112152070:case 1112152071:case 1112152073:case 1112152074:case 1112152076:case 1649022989:case 1112152078:return a.shm.getAtomShapeValue(b,
this.group,this.i);case 1111492618:return this.getBondingRadius();case 1111490563:return a.getNMRCalculation().getChemicalShift(this);case 1111490564:return JU.Elements.getCovalentRadius(this.atomicAndIsotopeNumber);case 1111490565:case 1111490576:case 1111490574:return this.group.getGroupParameter(b);case 1111492615:case 1111492612:return this.getFractionalCoord(!a.g.legacyJavaFloat,"X",!1,d);case 1111492616:case 1111492613:return this.getFractionalCoord(!a.g.legacyJavaFloat,"Y",!1,d);case 1111492617:case 1111492614:return this.getFractionalCoord(!a.g.legacyJavaFloat,
"Z",!1,d);case 1113589786:return this.getHydrophobicity();case 1111490566:return a.getNMRCalculation().getMagneticShielding(this);case 1111490567:return this.getMass();case 1128269825:return this.getOccupancy100()/100;case 1111492619:return this.getPartialCharge();case 1111490569:case 1111490570:case 1111490568:if(this.group.chain.model.isJmolDataFrame&&this.group.chain.model.jmolFrameType.startsWith("plot ramachandran"))switch(b){case 1111490569:return this.getFractionalCoord(!a.g.legacyJavaFloat,
"X",!1,d);case 1111490570:return this.getFractionalCoord(!a.g.legacyJavaFloat,"Y",!1,d);case 1111490568:if(this.group.chain.model.isJmolDataFrame&&this.group.chain.model.jmolFrameType.equals("plot ramachandran"))return a=this.getFractionalCoord(!a.g.legacyJavaFloat,"Z",!1,d)-180,-180>a?360+a:a}return this.group.getGroupParameter(b);case 1665140738:case 1112152075:return this.getRadius();case 1111490571:return a.antialiased?w(this.sX/2):this.sX;case 1111490572:return a.getScreenHeight()-(a.antialiased?
w(this.sY/2):this.sY);case 1111490573:return a.antialiased?w(this.sZ/2):this.sZ;case 1113589787:return a.slm.isAtomSelected(this.i)?1:0;case 1111490575:return a.ms.getSurfaceDistanceMax(),this.getSurfaceDistance100()/100;case 1111492620:return this.getBfactor100()/100;case 1111490577:return this.getFractionalUnitCoord(!a.g.legacyJavaFloat,"X",d);case 1111490578:return this.getFractionalUnitCoord(!a.g.legacyJavaFloat,"Y",d);case 1111490579:return this.getFractionalUnitCoord(!a.g.legacyJavaFloat,"Z",
d);case 1648363544:return this.getVanderwaalsRadiusFloat(a,J.c.VDW.AUTO);case 1648361473:return b=this.getVibrationVector(),null==b?0:b.length()*a.getFloat(1648361473);case 1111492626:return this.getVib("x");case 1111492627:return this.getVib("y");case 1111492628:return this.getVib("z");case 1111490583:return this.getVib("X");case 1111490584:return this.getVib("Y");case 1111490585:return this.getVib("Z");case 1111490586:return this.getVib("O");case 1111490580:return this.getVib("1");case 1111490581:return this.getVib("2");
case 1111490582:return this.getVib("3");case 1312817669:return this.getVolume(a,J.c.VDW.AUTO);case 1145047051:case 1145047053:case 1145045006:case 1145047052:case 1145047055:case 1145045008:case 1145047050:return a=this.atomPropertyTuple(a,b,d),null==a?-1:a.length()}return this.atomPropertyInt(b)},"JV.Viewer,~N,JU.P3");c(c$,"getVib",function(a){return this.group.chain.model.ms.getVibCoord(this.i,a)},"~S");c(c$,"getNominalMass",function(){var a=this.getIsotopeNumber();return 0<a?a:JU.Elements.getNaturalIsotope(this.getElementNumber())});
j(c$,"getMass",function(){var a=this.getIsotopeNumber();return 0<a?a:JU.Elements.getAtomicMass(this.getElementNumber())});c(c$,"atomPropertyString",function(a,b){var d;switch(b){case 1086324739:return d=this.altloc,"\x00"==d?"":""+d;case 1086326786:return this.getAtomName();case 1086326785:return this.getAtomType();case 1086326788:return this.getChainIDStr();case 1086324752:return this.getCIPChirality(!0);case 1086324753:return this.getCIPChiralityRule();case 1086324744:return this.getGroup1("?");
case 1086324747:return d=this.group.getSeqcodeString(),null==d?"":d;case 1086324743:return this.getGroup1("\x00");case 1086324742:return this.getGroup3(!1);case 1086326789:return this.getElementSymbolIso(!0);case 1086324745:return this.getIdentity(!0);case 1086324746:return d=this.group.getInsertionCode(),"\x00"==d?"":""+d;case 1825200146:case 1287653388:return d=a.shm.getShapePropertyIndex(5,"label",this.i),null==d&&(d=""),d;case 1639976963:return this.group.getProteinStructureType().getBioStructureTypeName(!1);
case 1237320707:return this.group.getProteinStructureSubType().getBioStructureTypeName(!1);case 1086324749:return this.group.getStructureId();case 1086324748:return a.getHybridizationAndAxes(this.i,null,null,"d");case 1086326798:return this.getElementSymbolIso(!1);case 1088421903:return this.getSymmetryOperatorList(!0)}return""},"JV.Viewer,~N");j(c$,"getCIPChirality",function(a){var b=(this.formalChargeAndFlags&496)>>4;0==b&&(1<this.atomicAndIsotopeNumber&&a)&&(b=this.group.chain.model.ms.getAtomCIPChiralityCode(this),
this.formalChargeAndFlags|=(0==b?3:b)<<4);return JV.JC.getCIPChiralityName(b)},"~B");c(c$,"getCIPChiralityRule",function(){var a=0==this.getCIPChirality(!0).length?-1:(this.formalChargeAndFlags&3584)>>9;return JV.JC.getCIPRuleName(a+1)});j(c$,"setCIPChirality",function(a){this.formalChargeAndFlags=this.formalChargeAndFlags&-4081|a<<4},"~N");j(c$,"getCIPChiralityCode",function(){return(this.formalChargeAndFlags&496)>>4});j(c$,"getInsertionCode",function(){return this.group.getInsertionCode()});c(c$,
"atomPropertyTuple",function(a,b,d){switch(b){case 1073742329:return JU.P3.newP(this);case 1145047051:return this.getFractionalCoordPt(!a.g.legacyJavaFloat,!1,d);case 1145047053:return this.getFractionalCoordPt(!a.g.legacyJavaFloat,!1,d);case 1145045006:return this.group.chain.model.isJmolDataFrame?this.getFractionalCoordPt(!a.g.legacyJavaFloat,!1,d):this.getFractionalUnitCoordPt(!a.g.legacyJavaFloat,!1,d);case 1145047052:return JU.P3.new3(a.antialiased?w(this.sX/2):this.sX,a.getScreenHeight()-(a.antialiased?
w(this.sY/2):this.sY),a.antialiased?w(this.sZ/2):this.sZ);case 1145047055:return this.getVibrationVector();case 1145045008:return a=this.getModulation(),null==a?null:a.getV3();case 1145047050:return this;case 1765808134:return JU.CU.colorPtFromInt(this.group.chain.model.ms.vwr.gdata.getColorArgbOrGray(this.colixAtom),d)}return null},"JV.Viewer,~N,JU.P3");j(c$,"getOffsetResidueAtom",function(a,b){return this.group.getAtomIndex(a,b)},"~S,~N");j(c$,"isCrossLinked",function(a){return this.group.isCrossLinked(a.group)},
"JU.Node");j(c$,"getCrossLinkVector",function(a,b,d){return this.group.getCrossLinkVector(a,b,d)},"JU.Lst,~B,~B");j(c$,"toString",function(){return this.getInfo()});j(c$,"findAtomsLike",function(a){return this.group.chain.model.ms.vwr.getAtomBitSet(a)},"~S");c(c$,"getUnitID",function(a){var b=this.group.chain.model;return b.isBioModel?b.getUnitID(this,a):""},"~N");j(c$,"getFloatProperty",function(a){a=this.group.chain.model.ms.vwr.getDataObj(a,null,1);var b=NaN;if(null!=a)try{b=a[this.i]}catch(d){if(!H(d,
Exception))throw d;}return b},"~S");j(c$,"modelIsRawPDB",function(){var a=this.group.chain.model;return a.isBioModel&&!a.isPdbWithMultipleBonds&&0==a.hydrogenCount});E(c$,"ATOM_INFRAME",1,"ATOM_VISSET",2,"ATOM_VISIBLE",4,"ATOM_NOTHIDDEN",8,"ATOM_NOFLAGS",-64,"ATOM_INFRAME_NOTHIDDEN",9,"ATOM_SHAPE_VIS_MASK",-10,"RADIUS_MAX",16,"RADIUS_GLOBAL",16.1,"MAD_GLOBAL",32200,"CHARGE_OFFSET",24,"FLAG_MASK",15,"VIBRATION_VECTOR_FLAG",1,"IS_HETERO_FLAG",2,"CIP_CHIRALITY_OFFSET",4,"CIP_CHIRALITY_MASK",496,"CIP_CHIRALITY_RULE_OFFSET",
9,"CIP_CHIRALITY_RULE_MASK",3584,"CIP_MASK",4080)});s("JM");v(["JU.V3"],"JM.AtomCollection","java.lang.Float java.util.Arrays $.Hashtable JU.A4 $.AU $.BS $.Lst $.M3 $.Measure $.P3 $.PT J.api.Interface $.JmolModulationSet J.atomdata.RadiusData J.c.PAL $.VDW JM.Group JS.T JU.BSUtil $.Elements $.Logger $.Parser $.Vibration".split(" "),function(){c$=t(function(){this.at=this.bioModelset=this.g3d=this.vwr=null;this.ac=0;this.labeler=this.pointGroup=this.trajectory=null;this.maxVanderwaalsRadius=this.maxBondingRadius=
1.4E-45;this.hasBfactorRange=!1;this.bfactor100Hi=this.bfactor100Lo=0;this.haveBSClickable=this.haveBSVisible=!1;this.bsSurface=null;this.surfaceDistanceMax=this.nSurfaceAtoms=0;this.haveChirality=!1;this.bspf=null;this.canSkipLoad=this.preserveState=!0;this.haveStraightness=!1;this.aaRet=this.bsPartialCharges=this.hydrophobicities=this.bondingRadii=this.partialCharges=this.bfactor100s=this.occupancies=this.vibrations=this.dssrData=this.atomSeqIDs=this.atomResnos=this.atomSerials=this.atomTypes=this.atomNames=
this.tainted=this.surfaceDistance100s=this.atomTensors=this.atomTensorList=this.bsModulated=this.bsClickable=this.bsVisible=this.bsHidden=null;R("JM.AtomCollection.AtomSorter")||JM.AtomCollection.$AtomCollection$AtomSorter$();this.atomCapacity=0;p(this,arguments)},JM,"AtomCollection");c(c$,"getAtom",function(a){return 0<=a&&a<this.at.length?this.at[a]:null},"~N");c(c$,"setupAC",function(){this.bsHidden=new JU.BS;this.bsVisible=new JU.BS;this.bsClickable=new JU.BS;null==JM.AtomCollection.userSettableValues&&
(JM.AtomCollection.userSettableValues="atomName atomType coord element formalCharge hydrophobicity ionic occupancy partialCharge temperature valence vanderWaals vibrationVector atomNo seqID resNo chain".$plit(" "))});c(c$,"releaseModelSetAC",function(){this.bfactor100s=this.occupancies=this.vibrations=this.atomSeqIDs=this.atomSerials=this.dssrData=this.atomResnos=this.atomTypes=this.atomNames=this.tainted=this.bsSurface=this.surfaceDistance100s=this.bspf=this.g3d=this.vwr=this.at=null;this.resetPartialCharges();
this.atomTensors=this.bondingRadii=null});c(c$,"mergeAtomArrays",function(a){this.tainted=a.tainted;this.atomNames=a.atomNames;this.atomTypes=a.atomTypes;this.atomResnos=a.atomResnos;this.dssrData=a.dssrData;this.atomSerials=a.atomSerials;this.atomSeqIDs=a.atomSeqIDs;this.vibrations=a.vibrations;this.occupancies=a.occupancies;this.bfactor100s=a.bfactor100s;this.bondingRadii=a.bondingRadii;this.partialCharges=a.partialCharges;this.bsPartialCharges=a.bsPartialCharges;this.atomTensors=a.atomTensors;
this.atomTensorList=a.atomTensorList;this.bsModulated=a.bsModulated;this.haveStraightness=!1;this.surfaceDistance100s=null},"JM.AtomCollection");c(c$,"getAtomPointVector",function(a){var b=new JU.Lst,d=this.ac;if(null!=a)for(var c=a.nextSetBit(0);0<=c&&c<d;c=a.nextSetBit(c+1))b.addLast(this.at[c]);return b},"JU.BS");c(c$,"modelSetHasVibrationVectors",function(){return null!=this.vibrations});c(c$,"getAtomTypes",function(){return this.atomTypes});c(c$,"getPartialCharges",function(){return this.partialCharges});
c(c$,"getBondingRadii",function(){return this.bondingRadii});c(c$,"getBFactors",function(){return this.bfactor100s});c(c$,"getHydrophobicity",function(){return this.hydrophobicities});c(c$,"setBsHidden",function(a){this.bsHidden=a},"JU.BS");c(c$,"isAtomHidden",function(a){return this.bsHidden.get(a)},"~N");c(c$,"getLabeler",function(){return null==this.labeler?this.labeler=J.api.Interface.getInterface("JM.LabelToken",this.vwr,"ms"):this.labeler});c(c$,"getAtomInfo",function(a,b,d){return null==b?
this.at[a].getInfo():this.getLabeler().formatLabel(this.vwr,this.at[a],b,d)},"~N,~S,JU.P3");c(c$,"getElementName",function(a){return JU.Elements.elementNameFromNumber(this.at[a].getAtomicAndIsotopeNumber())},"~N");c(c$,"getQuaternion",function(a,b){return 0>a?null:this.at[a].group.getQuaternion(b)},"~N,~S");c(c$,"getFirstAtomIndexFromAtomNumber",function(a,b){for(var d=0;d<this.ac;d++){var c=this.at[d];if(null!=c&&c.getAtomNumber()==a&&b.get(c.mi))return d}return-1},"~N,JU.BS");c(c$,"setFormalCharges",
function(a,b){if(null!=a){this.resetPartialCharges();for(var d=a.nextSetBit(0);0<=d;d=a.nextSetBit(d+1))this.at[d].setFormalCharge(b),this.taintAtom(d,4)}},"JU.BS,~N");c(c$,"getAtomicCharges",function(){for(var a=K(this.ac,0),b=this.ac;0<=--b;)a[b]=null==this.at[b]?0:this.at[b].getElementNumber();return a});c(c$,"getRadiusVdwJmol",function(a){return JU.Elements.getVanderwaalsMar(a.getElementNumber(),J.c.VDW.JMOL)/1E3},"JM.Atom");c(c$,"getMaxVanderwaalsRadius",function(){1.4E-45==this.maxVanderwaalsRadius&&
this.findMaxRadii();return this.maxVanderwaalsRadius});c(c$,"findMaxRadii",function(){for(var a,b=this.ac;0<=--b;){var d=this.at[b];if(null!=d){if((a=d.getBondingRadius())>this.maxBondingRadius)this.maxBondingRadius=a;if((a=d.getVanderwaalsRadiusFloat(this.vwr,J.c.VDW.AUTO))>this.maxVanderwaalsRadius)this.maxVanderwaalsRadius=a}}});c(c$,"clearBfactorRange",function(){this.hasBfactorRange=!1});c(c$,"calcBfactorRange",function(a){if(!this.hasBfactorRange){this.bfactor100Lo=2147483647;this.bfactor100Hi=
-2147483648;if(null==a)for(var b=0;b<this.ac;b++)this.setBf(b);else for(b=a.nextSetBit(0);0<=b;b=a.nextSetBit(b+1))this.setBf(b);this.hasBfactorRange=!0}},"JU.BS");c(c$,"setBf",function(a){null!=this.at[a]&&(a=this.at[a].getBfactor100(),a<this.bfactor100Lo?this.bfactor100Lo=a:a>this.bfactor100Hi&&(this.bfactor100Hi=a))},"~N");c(c$,"getBfactor100Lo",function(){this.hasBfactorRange||(this.vwr.g.rangeSelected?this.calcBfactorRange(this.vwr.bsA()):this.calcBfactorRange(null));return this.bfactor100Lo});
c(c$,"getBfactor100Hi",function(){this.getBfactor100Lo();return this.bfactor100Hi});c(c$,"getSurfaceDistanceMax",function(){null==this.surfaceDistance100s&&this.calcSurfaceDistances();return this.surfaceDistanceMax});c(c$,"calculateVolume",function(a,b){var d=0;if(null!=a)for(var c=a.nextSetBit(0);0<=c;c=a.nextSetBit(c+1))d+=this.at[c].getVolume(this.vwr,b);return d},"JU.BS,J.c.VDW");c(c$,"getSurfaceDistance100",function(a){if(0==this.nSurfaceAtoms)return-1;null==this.surfaceDistance100s&&this.calcSurfaceDistances();
return this.surfaceDistance100s[a]},"~N");c(c$,"calcSurfaceDistances",function(){this.calculateSurface(null,-1)});c(c$,"calculateSurface",function(a,b){0>b&&(b=3);var d=J.api.Interface.getOption("geodesic.EnvelopeCalculation",this.vwr,"ms").set(this.vwr,this.ac,null);d.calculate(new J.atomdata.RadiusData(null,b,J.atomdata.RadiusData.EnumType.ABSOLUTE,null),3.4028235E38,a,JU.BSUtil.copyInvert(a,this.ac),!1,!1,!1,!0);var c=d.getPoints();this.surfaceDistanceMax=0;this.bsSurface=d.getBsSurfaceClone();
this.surfaceDistance100s=B(this.ac,0);this.nSurfaceAtoms=JU.BSUtil.cardinalityOf(this.bsSurface);if(0==this.nSurfaceAtoms||null==c||0==c.length)return c;for(var d=3.4028235E38==b?0:b,f=0;f<this.ac;f++)if(this.bsSurface.get(f)||null==this.at[f])this.surfaceDistance100s[f]=0;else{for(var e=3.4028235E38,h=this.at[f],k=c.length;0<=--k;)e=Math.min(Math.abs(c[k].distance(h)-d),e);e=this.surfaceDistance100s[f]=w(Math.floor(100*e));this.surfaceDistanceMax=Math.max(this.surfaceDistanceMax,e)}return c},"JU.BS,~N");
c(c$,"setAtomCoord2",function(a,b,d){var c=null,f=null,e=null,h=0,k=1;if(n(d,JU.P3))c=d;else if(n(d,JU.Lst)){e=d;if(0==(k=e.size()))return;h=1}else if(JU.AU.isAP(d)){f=d;if(0==(k=f.length))return;h=2}else return;d=0;if(null!=a)for(var j=a.nextSetBit(0);0<=j;j=a.nextSetBit(j+1)){switch(h){case 1:if(d>=k)return;c=e.get(d++);break;case 2:if(d>=k)return;c=f[d++]}if(null!=c)switch(b){case 1145047050:this.setAtomCoord(j,c.x,c.y,c.z);break;case 1145047051:this.at[j].setFractionalCoordTo(c,!0);this.taintAtom(j,
2);break;case 1145047053:this.at[j].setFractionalCoordTo(c,!1);this.taintAtom(j,2);break;case 1145047055:this.setAtomVibrationVector(j,c)}}},"JU.BS,~N,~O");c(c$,"setAtomVibrationVector",function(a,b){this.setVibrationVector(a,b);this.taintAtom(a,12)},"~N,JU.T3");c(c$,"setAtomCoord",function(a,b,d,c){if(!(0>a||a>=this.ac)){var f=this.at[a];f.set(b,d,c);this.fixTrajectory(f);this.taintAtom(a,2)}},"~N,~N,~N,~N");c(c$,"fixTrajectory",function(a){this.isTrajectory(a.mi)&&this.trajectory.fixAtom(a)},"JM.Atom");
c(c$,"setAtomCoordRelative",function(a,b,d,c){if(!(0>a||a>=this.ac)){var f=this.at[a];f.add3(b,d,c);this.fixTrajectory(f);this.taintAtom(a,2)}},"~N,~N,~N,~N");c(c$,"setAtomsCoordRelative",function(a,b,d,c){if(null!=a)for(var f=a.nextSetBit(0);0<=f;f=a.nextSetBit(f+1))this.setAtomCoordRelative(f,b,d,c)},"JU.BS,~N,~N,~N");c(c$,"setAPa",function(a,b,d,c,f,e,h){var k=0;if(!(null!=e&&0==e.length||null==a)){for(var j=null!=e&&e.length==this.ac||null!=h&&h.length==this.ac,z=a.nextSetBit(0);0<=z;z=a.nextSetBit(z+
1)){j&&(k=z);if(null!=e){if(k>=e.length)return;c=e[k++];if(Float.isNaN(c))continue;d=A(c)}else if(null!=h){if(k>=h.length)return;f=h[k++]}var m=this.at[z],r;switch(b){case 1086326786:this.setAtomName(z,f,!0);break;case 1086326785:this.setAtomType(z,f);break;case 1086326788:this.setChainID(z,f);break;case 1094715393:this.setAtomNumber(z,d,!0);break;case 1094713365:this.setAtomSeqID(z,d);break;case 1111492609:case 1111492629:this.setAtomCoord(z,c,m.y,m.z);break;case 1111492610:case 1111492630:this.setAtomCoord(z,
m.x,c,m.z);break;case 1111492611:case 1111492631:this.setAtomCoord(z,m.x,m.y,c);break;case 1111492626:case 1111492627:case 1111492628:this.setVibrationVector2(z,b,c);break;case 1111492612:case 1111492613:case 1111492614:m.setFractionalCoord(b,c,!0);this.taintAtom(z,2);break;case 1111492615:case 1111492616:case 1111492617:m.setFractionalCoord(b,c,!1);this.taintAtom(z,2);break;case 1094715402:case 1086326789:this.setElement(m,d,!0);break;case 1631586315:this.resetPartialCharges();m.setFormalCharge(d);
this.taintAtom(z,4);break;case 1113589786:this.setHydrophobicity(z,c);break;case 1128269825:r=2>c&&0.01<=c?100*c:c;this.setOccupancy(z,r,!0);break;case 1111492619:this.setPartialCharge(z,c,!0);break;case 1111492618:this.setBondingRadius(z,c);break;case 1111492620:this.setBFactor(z,c,!0);break;case 1094715412:this.setAtomResno(z,d);break;case 1825200146:case 1287653388:this.vwr.shm.setAtomLabel(f,z);break;case 1665140738:case 1112152075:r=c;0>r?r=0:16<r&&(r=16.1);m.madAtom=$(2E3*r);break;case 1113589787:this.vwr.slm.setSelectedAtom(m.i,
0!=c);break;case 1094715417:m.setValence(d);this.taintAtom(z,10);break;case 1648363544:m.setRadius(c)?this.taintAtom(z,11):this.untaint(z,11);break;default:JU.Logger.error("unsettable atom property: "+JS.T.nameOf(b));return}}switch(b){case 1113589787:this.vwr.slm.setSelectedAtom(-1,!1);break;case 1665140738:case 1112152075:this.vwr.setShapeSize(0,2147483647,a)}}},"JU.BS,~N,~N,~N,~S,~A,~A");c(c$,"getVibCoord",function(a,b){var d=null,c=null;switch(b){case "x":case "y":case "z":c=this.getVibration(a,
!1);break;default:d=this.getModulation(a),null!=d&&(c=d.getVibration(!1),null==c&&(c=d))}if(null==c&&null==d)return NaN;switch(b){case "x":case "X":return c.x;case "y":case "Y":return c.y;case "z":case "Z":return c.z;case "O":return d.getModulation("O",null).floatValue();case "1":case "2":case "3":return d=d.getModulation("T",null),d="1"==b?d.x:"2"==b?d.y:d.z,d-Math.floor(d);default:return NaN}},"~N,~S");c(c$,"getVibration",function(a,b){var d=null==this.vibrations?null:this.vibrations[a];return n(d,
J.api.JmolModulationSet)?d.getVibration(b):null==d&&b?new JU.Vibration:d},"~N,~B");c(c$,"getModulation",function(a){a=null==this.vibrations?null:this.vibrations[a];return null!=a&&0<a.modDim?a:null},"~N");c(c$,"setVibrationVector",function(a,b){if(!Float.isNaN(b.x)&&!Float.isNaN(b.y)&&!Float.isNaN(b.z)){if(null==this.vibrations||this.vibrations.length<a)this.vibrations=Array(this.at.length);n(b,JU.Vibration)?this.vibrations[a]=b:(null==this.vibrations[a]&&(this.vibrations[a]=new JU.Vibration),this.vibrations[a].setXYZ(b));
this.at[a].setVibrationVector()}},"~N,JU.T3");c(c$,"setVibrationVector2",function(a,b,d){var c=this.getVibration(a,!0);if(null!=c){switch(b){case 1111492626:c.x=d;break;case 1111492627:c.y=d;break;case 1111492628:c.z=d}this.setAtomVibrationVector(a,c)}},"~N,~N,~N");c(c$,"setAtomName",function(a,b,d){if(!d||!b.equals(this.at[a].getAtomName())){var c=this.am[this.at[a].mi].isBioModel?this.vwr.getJBR().lookupSpecialAtomID(b):0;this.at[a].atomID=c;0>=c&&(null==this.atomNames&&(this.atomNames=Array(this.at.length)),
this.atomNames[a]=b);d&&this.taintAtom(a,0)}},"~N,~S,~B");c(c$,"setAtomType",function(a,b){b.equals(this.at[a].getAtomType())||(null==this.atomTypes&&(this.atomTypes=Array(this.at.length)),this.atomTypes[a]=b)},"~N,~S");c(c$,"setChainID",function(a,b){if(!b.equals(this.at[a].getChainIDStr())){var d=this.at[a].getChainID(),d=this.getChainBits(d);this.at[a].group.chain.chainID=this.vwr.getChainID(b,!0);for(var c=d.nextSetBit(0);0<=c;c=d.nextSetBit(c+1))this.taintAtom(c,16)}},"~N,~S");c(c$,"setAtomNumber",
function(a,b,d){d&&b==this.at[a].getAtomNumber()||(null==this.atomSerials&&(this.atomSerials=B(this.at.length,0)),this.atomSerials[a]=b,d&&this.taintAtom(a,13))},"~N,~N,~B");c(c$,"setElement",function(a,b,d){d&&a.getElementNumber()==b||(a.setAtomicAndIsotopeNumber(b),a.paletteID=J.c.PAL.CPK.id,a.colixAtom=this.vwr.cm.getColixAtomPalette(a,J.c.PAL.CPK.id),this.resetPartialCharges(),d&&this.taintAtom(a.i,3))},"JM.Atom,~N,~B");c(c$,"resetPartialCharges",function(){this.bsPartialCharges=this.partialCharges=
null});c(c$,"setAtomResno",function(a,b){b!=this.at[a].getResno()&&(this.at[a].group.setResno(b),null==this.atomResnos&&(this.atomResnos=B(this.at.length,0)),this.atomResnos[a]=b,this.taintAtom(a,15))},"~N,~N");c(c$,"setAtomSeqID",function(a,b){b!=this.at[a].getSeqID()&&(null==this.atomSeqIDs&&(this.atomSeqIDs=B(this.at.length,0)),this.atomSeqIDs[a]=b,this.taintAtom(a,14))},"~N,~N");c(c$,"setOccupancy",function(a,b,d){if(!(d&&b==this.at[a].getOccupancy100())){if(null==this.occupancies){if(100==b)return;
this.occupancies=K(this.at.length,0);for(var c=this.at.length;0<=--c;)this.occupancies[c]=100}this.occupancies[a]=b;d&&this.taintAtom(a,7)}},"~N,~N,~B");c(c$,"setPartialCharge",function(a,b,d){if(!Float.isNaN(b)){if(null==this.partialCharges){this.bsPartialCharges=new JU.BS;if(0==b)return;this.partialCharges=K(this.at.length,0)}this.bsPartialCharges.set(a);this.partialCharges[a]=b;d&&this.taintAtom(a,8)}},"~N,~N,~B");c(c$,"setBondingRadius",function(a,b){Float.isNaN(b)||b==this.at[a].getBondingRadius()||
(null==this.bondingRadii?this.bondingRadii=K(this.at.length,0):this.bondingRadii.length<this.at.length&&(this.bondingRadii=JU.AU.ensureLength(this.bondingRadii,this.at.length)),this.bondingRadii[a]=b,this.taintAtom(a,6))},"~N,~N");c(c$,"setBFactor",function(a,b,d){if(!(Float.isNaN(b)||d&&b==this.at[a].getBfactor100())){if(null==this.bfactor100s){if(0==b)return;this.bfactor100s=T(this.at.length,0)}this.bfactor100s[a]=ta(100*(-327.68>b?-327.68:327.67<b?327.67:b)+(0>b?-0.5:0.5));d&&this.taintAtom(a,
9)}},"~N,~N,~B");c(c$,"setHydrophobicity",function(a,b){if(!(Float.isNaN(b)||b==this.at[a].getHydrophobicity())){if(null==this.hydrophobicities){this.hydrophobicities=K(this.at.length,0);for(var d=0;d<this.at.length;d++)this.hydrophobicities[d]=JU.Elements.getHydrophobicity(this.at[d].group.groupID)}this.hydrophobicities[a]=b;this.taintAtom(a,5)}},"~N,~N");c(c$,"setAtomData",function(a,b,d,c){var f=null,e=null;switch(a){case 2:this.loadCoordinates(d,!1,!c);return;case 12:this.loadCoordinates(d,!0,
!0);return;case 17:f=K(this.ac,0),e=JU.BS.newN(this.ac)}c=JU.Parser.markLines(d,";");var h=0;try{for(var k=JU.PT.parseInt(d.substring(0,c[0]-1)),j=1;j<=k;j++){var z=JU.PT.getTokens(JU.PT.parseTrimmed(d.substring(c[j],c[j+1]-1))),m=JU.PT.parseInt(z[0])-1;if(!(0>m||m>=this.ac)){var r=this.at[m];h++;var x=z.length-1,y=JU.PT.parseFloat(z[x]);switch(a){case 17:f[m]=y;e.set(m);continue;case 0:this.setAtomName(m,z[x],!0);break;case 13:this.setAtomNumber(m,A(y),!0);break;case 15:this.setAtomResno(m,A(y));
break;case 14:this.setAtomSeqID(m,A(y));break;case 1:this.setAtomType(m,z[x]);break;case 16:this.setChainID(m,z[x]);break;case 3:r.setAtomicAndIsotopeNumber(A(y));r.paletteID=J.c.PAL.CPK.id;r.colixAtom=this.vwr.cm.getColixAtomPalette(r,J.c.PAL.CPK.id);break;case 4:r.setFormalCharge(A(y));break;case 5:this.setHydrophobicity(m,y);break;case 6:this.setBondingRadius(m,y);break;case 8:this.setPartialCharge(m,y,!0);break;case 9:this.setBFactor(m,y,!0);break;case 10:r.setValence(A(y));break;case 11:r.setRadius(y)}this.taintAtom(m,
a)}}17==a&&0<h&&this.vwr.setData(b,u(-1,[b,f,e,Integer.$valueOf(1)]),0,0,0,0,0)}catch(n){if(H(n,Exception))JU.Logger.error("AtomCollection.loadData error: "+n);else throw n;}},"~N,~S,~S,~B");c(c$,"loadCoordinates",function(a,b,d){var c=JU.Parser.markLines(a,";"),f=b?new JU.V3:null;try{for(var e=JU.PT.parseInt(a.substring(0,c[0]-1)),h=1;h<=e;h++){var k=JU.PT.getTokens(JU.PT.parseTrimmed(a.substring(c[h],c[h+1]))),j=JU.PT.parseInt(k[0])-1,z=k[3].equalsIgnoreCase("1.4E-45")?1.4E-45:JU.PT.parseFloat(k[3]),
m=k[4].equalsIgnoreCase("1.4E-45")?1.4E-45:JU.PT.parseFloat(k[4]),r=JU.PT.parseFloat(k[5]);b?(f.set(z,m,r),this.setAtomVibrationVector(j,f)):(this.setAtomCoord(j,z,m,r),d||this.untaint(j,2))}}catch(x){if(H(x,Exception))JU.Logger.error("Frame.loadCoordinate error: "+x);else throw x;}},"~S,~B,~B");c(c$,"validateBspf",function(a){null!=this.bspf&&(this.bspf.isValid=a)},"~B");c(c$,"validateBspfForModel",function(a,b){null!=this.bspf&&this.bspf.validateModel(a,b)},"~N,~B");c(c$,"setPreserveState",function(a){this.preserveState=
a},"~B");c$.getUserSettableType=c(c$,"getUserSettableType",function(a){var b=0==a.indexOf("property_");a=b?a.substring(9):a;for(var d=0;17>d;d++)if(JM.AtomCollection.userSettableValues[d].equalsIgnoreCase(a))return d;return b?17:-1},"~S");c(c$,"getTaintedAtoms",function(a){return null==this.tainted?null:this.tainted[a]},"~N");c(c$,"taintAtoms",function(a,b){this.canSkipLoad=!1;if(this.preserveState)for(var d=a.nextSetBit(0);0<=d;d=a.nextSetBit(d+1))this.taintAtom(d,b)},"JU.BS,~N");c(c$,"taintAtom",
function(a,b){this.preserveState&&(null==this.tainted&&(this.tainted=Array(17)),null==this.tainted[b]&&(this.tainted[b]=JU.BS.newN(this.ac)),this.tainted[b].set(a));2==b&&this.taintModelCoord(a)},"~N,~N");c(c$,"taintModelCoord",function(a){a=this.am[this.at[a].mi];this.validateBspfForModel(a.trajectoryBaseIndex,!1);a.isBioModel&&a.resetDSSR(!0);this.pointGroup=null},"~N");c(c$,"untaint",function(a,b){this.preserveState&&(null==this.tainted||null==this.tainted[b]||this.tainted[b].clear(a))},"~N,~N");
c(c$,"setTaintedAtoms",function(a,b){if(this.preserveState){if(null==a){if(null==this.tainted)return;this.tainted[b]=null;return}null==this.tainted&&(this.tainted=Array(17));null==this.tainted[b]&&(this.tainted[b]=JU.BS.newN(this.ac));JU.BSUtil.copy2(a,this.tainted[b])}if(2==b){var d=a.nextSetBit(0);0<=d&&this.taintModelCoord(d)}},"JU.BS,~N");c(c$,"unTaintAtoms",function(a,b){if(!(null==this.tainted||null==this.tainted[b])){for(var d=a.nextSetBit(0);0<=d;d=a.nextSetBit(d+1))this.tainted[b].clear(d);
0>this.tainted[b].nextSetBit(0)&&(this.tainted[b]=null)}},"JU.BS,~N");c(c$,"findNearest2",function(a,b,d,c,f){for(var e=null,h,k=this.ac;0<=--k;)if(!(null!=c&&c.get(k)||null==(h=this.at[k])))h.isClickable()&&this.isCursorOnTopOf(h,a,b,f,e)&&(e=h);d[0]=e},"~N,~N,~A,JU.BS,~N");c(c$,"isCursorOnTopOf",function(a,b,d,c,f){return 1<a.sZ&&!this.g3d.isClippedZ(a.sZ)&&this.g3d.isInDisplayRange(a.sX,a.sY)&&a.isCursorOnTopOf(b,d,c,f)},"JM.Atom,~N,~N,~N,JM.Atom");c(c$,"fillADa",function(a,b){a.xyz=a.atoms=this.at;
a.ac=this.ac;a.atomicNumber=B(this.ac,0);var d=0!=(b&2);d&&(a.atomRadius=K(this.ac,0));for(var c=0!=(b&16),f=0;f<this.ac;f++){var e=this.at[f];null==e||e.isDeleted()||!c&&0<=a.modelIndex&&e.mi!=a.firstModelIndex?(null==a.bsIgnored&&(a.bsIgnored=new JU.BS),a.bsIgnored.set(f)):(a.atomicNumber[f]=e.getElementNumber(),a.lastModelIndex=e.mi,d&&(a.atomRadius[f]=this.getWorkingRadius(e,a)))}},"J.atomdata.AtomData,~N");c(c$,"getWorkingRadius",function(a,b){var d=0,c=b.radiusData;switch(c.factorType){case J.atomdata.RadiusData.EnumType.ABSOLUTE:d=
c.value;break;case J.atomdata.RadiusData.EnumType.FACTOR:case J.atomdata.RadiusData.EnumType.OFFSET:switch(c.vdwType){case J.c.VDW.BONDING:d=a.getBondingRadius();break;case J.c.VDW.ADPMAX:d=a.getADPMinMax(!0);break;case J.c.VDW.ADPMIN:d=a.getADPMinMax(!1);break;default:d=a.getVanderwaalsRadiusFloat(this.vwr,b.radiusData.vdwType)}d=c.factorType===J.atomdata.RadiusData.EnumType.FACTOR?d*c.value:d+c.value}return d+c.valueExtended},"JM.Atom,J.atomdata.AtomData");c(c$,"calculateHydrogens",function(a,b,
d,c){var f=256==(c&256),e=512==(c&512),h=4==(c&4),k=2048==(c&2048);c=4096==(c&4096);var j=new JU.V3,z=new JU.V3,m=Array(this.ac),r=this.vwr.slm.bsDeleted,x,y=0;if(null!=a)for(var n=a.nextSetBit(0);0<=n;n=a.nextSetBit(n+1))if(!(null!=r&&r.get(n))){var p=this.at[n],q=p.getElementNumber();if(!(e&&6!=q)){var s=6>=q?1.1:10>=q?1:1.3;switch(q){case 7:case 8:s=1}x=f||k||c?p.getCovalentHydrogenCount():0;if(!(f&&0<x||k&&0==x)){var u=this.getMissingHydrogenCount(p,!1);if(!(f&&0==u)){k||(x=u);var u=this.aaRet[0],
t=this.aaRet[2],v=this.aaRet[3]-(k?x:0);if(!(0==v&&p.isHetero())){m[n]=Array(x);var w=0;if(0==v)switch(x){case 4:j.set(0.635,0.635,0.635),x=JU.P3.newP(j),x.add(p),m[n][w++]=x,null!=d&&d.addLast(p);case 3:j.set(-0.635,-0.635,0.635),x=JU.P3.newP(j),x.add(p),m[n][w++]=x,null!=d&&d.addLast(p);case 2:j.set(-0.635,0.635,-0.635),x=JU.P3.newP(j),x.add(p),m[n][w++]=x,null!=d&&d.addLast(p);case 1:j.set(0.635,-0.635,-0.635),x=JU.P3.newP(j),x.add(p),m[n][w++]=x,null!=d&&d.addLast(p)}else switch(x){case 3:this.getHybridizationAndAxes(n,
q,j,z,"sp3b",!1,!0,h);x=new JU.P3;x.scaleAdd2(s,j,p);m[n][w++]=x;null!=d&&d.addLast(p);this.getHybridizationAndAxes(n,q,j,z,"sp3c",!1,!0,h);x=new JU.P3;x.scaleAdd2(s,j,p);m[n][w++]=x;null!=d&&d.addLast(p);this.getHybridizationAndAxes(n,q,j,z,"sp3d",!1,!0,h);x=new JU.P3;x.scaleAdd2(s,j,p);m[n][w++]=x;null!=d&&d.addLast(p);break;case 2:t=2==t||5==q||1==v&&4==u||7==q&&this.isAdjacentSp2(p);this.getHybridizationAndAxes(n,q,j,z,t?"sp2b":3==u?"sp3c":"lpa",!1,!0,h);x=JU.P3.newP(j);x.scaleAdd2(s,j,p);m[n][w++]=
x;null!=d&&d.addLast(p);this.getHybridizationAndAxes(n,q,j,z,t?"sp2c":3==u?"sp3d":"lpb",!1,!0,h);x=JU.P3.newP(j);x.scaleAdd2(s,j,p);m[n][w++]=x;null!=d&&d.addLast(p);break;case 1:switch(u-v){case 1:if(8==q&&p===p.group.getCarbonylOxygenAtom()){m[n]=null;continue}null!=this.getHybridizationAndAxes(n,q,j,z,2==t||5==q||6==q&&1==this.aaRet[1]||7==q&&(new Boolean((new Boolean(p.group.getNitrogenAtom()===p&0==p.getFormalCharge())).valueOf()||this.isAdjacentSp2(p))).valueOf()?"sp2c":"sp3d",!0,!1,h)?(x=JU.P3.newP(j),
x.scaleAdd2(s,j,p),m[n][w++]=x,null!=d&&d.addLast(p)):m[n]=[];break;case 2:this.getHybridizationAndAxes(n,q,j,z,4==u?"sp2c":"sp2b",!1,!1,h);x=JU.P3.newP(j);x.scaleAdd2(s,j,p);m[n][w++]=x;null!=d&&d.addLast(p);break;case 3:this.getHybridizationAndAxes(n,q,j,z,"spb",!1,!0,h),x=JU.P3.newP(j),x.scaleAdd2(s,j,p),m[n][w++]=x,null!=d&&d.addLast(p)}}y+=w}}}}}b[0]=y;return m},"JU.BS,~A,JU.Lst,~N");c(c$,"isAdjacentSp2",function(a){for(var b=a.bonds,d=0;d<b.length;d++)for(var c=b[d].getOtherAtom(a).bonds,f=
0;f<c.length;f++)switch(c[f].getCovalentOrder()){case 2:case 3:return!0}return!1},"JM.Atom");c(c$,"getMissingHydrogenCount",function(a,b){var d=a.getTargetValence();if(0>d)return 0;var c=a.getFormalCharge(),f=a.getValence(),e=this.am[a.mi],e=e.isBioModel&&!e.isPdbWithMultipleBonds?a.group.getGroup3():null;null==this.aaRet&&(this.aaRet=B(5,0));this.aaRet[0]=d;this.aaRet[1]=c;this.aaRet[2]=0;this.aaRet[3]=a.getCovalentBondCount();this.aaRet[4]=null==e?0:f;null!=e&&0==c&&this.bioModelset.getAminoAcidValenceAndCharge(e,
a.getAtomName(),this.aaRet)&&(d=this.aaRet[0],c=this.aaRet[1]);0!=c&&(d+=4==d?-Math.abs(c):c,this.aaRet[0]=d);d-=f;return 0>d&&!b?0:d},"JM.Atom,~B");c(c$,"fixFormalCharges",function(a){for(var b=0,d=a.nextSetBit(0);0<=d;d=a.nextSetBit(d+1)){var c=this.at[d],f=this.getMissingHydrogenCount(c,!0);if(0!=f){var e=c.getFormalCharge(),f=e-f;c.setFormalCharge(f);this.taintAtom(d,4);JU.Logger.debugging&&JU.Logger.debug("atom "+c+" formal charge "+e+" -> "+f);b++}}return b},"JU.BS");c(c$,"getHybridizationAndAxes",
function(a,b,d,c,f,e,h,k){var j=0<f.length&&"-"==f.charAt(0)?f.substring(1):f;if(0<=f.indexOf("d")&&!f.endsWith("sp3d"))return this.getHybridizationAndAxesD(a,d,c,j);f=this.at[a];0==b&&(b=f.getElementNumber());var z=this.getAttached(f,4,e,k),m=z.length,r=j.charCodeAt(j.length-1)-97;if(0>r||6<r)r=0;d.set(0,0,0);c.set(0,0,0);for(var n=Array(4),y=0;y<m;y++){var p=z[y];if(null==p){m=y;break}n[y]=JU.V3.newVsub(f,p);n[y].normalize();d.add(n[y])}0<m&&c.setT(n[0]);p=!1;a=new JU.V3;if(3<=m){2.984513>c.angle(n[1])?
a.cross(c,n[1]):a.cross(c,n[2]);a.normalize();var q=new JU.V3;2.984513>n[1].angle(n[2])?q.cross(n[1],n[2]):q.cross(c,n[2]);q.normalize();p=0.95<=Math.abs(q.dot(a))}var y=0==j.indexOf("sp3"),s=!y&&0==j.indexOf("sp2"),u=!y&&!s&&0==j.indexOf("sp"),t=0==j.indexOf("p"),v=0==j.indexOf("lp"),q=null;if(e){if(0==m)return null;if(y){if(3<r||4<m)return null}else if(s){if(2<r||3<m)return null}else if(u&&(1<r||2<m))return null;switch(m){case 1:if(1==b&&!y)return null;if(y){q="sp3";break}switch(z[0].getCovalentBondCount()){case 1:if(2!=
z[0].getValence()){q="sp";break}case 2:q=u?"sp":"sp2";break;case 3:if(!s&&!t)return null;q="sp2"}break;case 2:if(0.1>d.length()){if(0<=j.indexOf("2")||0<=j.indexOf("3"))return null;q="sp";break}q=y?"sp3":"sp2";if(0==j.indexOf("sp"))break;if(v){q="lp";break}q=j;break;default:if(p&&!k)q="sp2";else{p&&d.setT(a);if(v&&3==m){q="lp";break}q="sp3"}}if(null==q)return null;if(0==j.indexOf("p")){if("sp3"===q)return null}else if(0>j.indexOf(q))return null}if(r<m&&!j.startsWith("p")&&!j.startsWith("l"))return d.sub2(z[r],
f),d.normalize(),q;switch(m){case 0:j.equals("sp3c")||j.equals("sp2d")||j.equals("lpa")?d.set(-0.5,-0.7,1):j.equals("sp3b")||j.equals("lpb")?d.set(0.5,-0.7,-1):j.equals("sp3a")?d.set(0,1,0):d.set(0,0,1);c.set(1,0,0);break;case 1:a.setT(JM.AtomCollection.vRef);c.cross(a,d);if(y){for(y=z[0].getBondCount();0<=--y;)if(z[0].bonds[y].isCovalent()&&z[0].getBondedAtomIndex(y)!=f.i&&(c.sub2(z[0],z[0].bonds[y].getOtherAtom(z[0])),c.cross(d,c),0!=c.length())){c.cross(c,d);break}c.normalize();Float.isNaN(c.x)&&
(c.setT(JM.AtomCollection.vRef),c.cross(c,d));a.cross(d,c);a.normalize();d.normalize();c.scaleAdd2(2.828,c,d);3!=r&&(c.normalize(),(new JU.M3).setAA(JU.A4.new4(d.x,d.y,d.z,2.09439507*(2==r?1:-1))).rotate(c));d.setT(c);c.cross(a,d);break}a.cross(c,d);switch(z[0].getCovalentBondCount()){case 1:if(2!=z[0].getValence())break;case 2:h=z[0];c.setT(d);for(a.setT(JM.AtomCollection.vRef);null!=h&&2==h.getCovalentBondCount();){k=h.bonds;p=null;for(y=0;y<k.length;y++)if(k[y].isCovalent()&&(p=k[y].getOtherAtom(h),
p!==f)){a.sub2(p,h);break}a.cross(a,c);if(0.1<a.length()||2!=p.getCovalentBondCount())break;f=h;h=p}u||(0.1<a.length()?(d.cross(a,c),d.normalize(),1==r&&d.scale(-1),d.scale(JM.AtomCollection.sqrt3_2),d.scaleAdd2(0.5,c,d),t&&(a.cross(d,c),d.setT(a),a.setT(c)),c.cross(a,d)):(d.setT(c),c.cross(JM.AtomCollection.vRef,c)));break;case 3:this.getHybridizationAndAxes(z[0].i,0,c,a,"pz",!1,h,k),a.setT(c),s?(c.cross(c,d),1==r&&c.scale(-1),c.scale(JM.AtomCollection.sqrt3_2),d.scaleAdd2(0.5,d,c)):u||(a.setT(d),
d.setT(c)),c.cross(a,d)}break;case 2:if(0.1>d.length()){if(!j.equals("pz")){p=z[0];(b=3==p.getCovalentBondCount())||(b=3==(p=z[1]).getCovalentBondCount());if(b){this.getHybridizationAndAxes(p.i,0,c,d,"pz",!1,h,k);j.equals("px")&&c.scale(-1);d.setT(n[0]);break}a.setT(JM.AtomCollection.vRef);d.cross(a,c);a.cross(d,c)}d.setT(c);c.cross(a,d);break}a.cross(d,c);if(s){c.cross(d,a);break}if(y||v){a.normalize();d.normalize();j.equals("lp")||(0==r||2==r?d.scaleAdd2(-1.2,a,d):d.scaleAdd2(1.2,a,d));c.cross(d,
a);break}c.cross(d,a);d.setT(a);0>d.z&&(d.scale(-1),c.scale(-1));break;default:if(y)break;if(!p){c.cross(d,c);break}d.setT(a);0>d.z&&h&&(d.scale(-1),c.scale(-1))}c.normalize();d.normalize();return q},"~N,~N,JU.V3,JU.V3,~S,~B,~B,~B");c(c$,"getHybridizationAndAxesD",function(a,b,d,c){c.startsWith("sp3d2")&&(c="d2sp3"+(5==c.length?"a":c.substring(5)));c.startsWith("sp3d")&&(c="dsp3"+(4==c.length?"a":c.substring(4)));if(c.equals("d2sp3")||c.equals("dsp3"))c+="a";var f=c.startsWith("dsp3"),e=c.charCodeAt(c.length-
1)-97;if(null!=b&&(!f&&(5<e||!c.startsWith("d2sp3"))||f&&4<e))return null;a=this.at[a];c=this.getAttached(a,6,!0,!1);if(null==c)return null==b?null:"?";var h=c.length;if(3>h&&null!=b)return null;for(var k=e>=h,j=w(h*(h-1)/2),z=JU.AU.newInt2(j),m=B(3,0),j=B(3,j,0),r=0,n=0,y=0;y<h-1;y++)for(var p=y+1;p<h;p++){var q=JU.Measure.computeAngleABC(c[y],a,c[p],!0),q=105>q?0:150<=q?2:1;j[q][m[q]]=r;m[q]++;z[r++]=B(-1,[y,p]);0==y&&1==q&&n++}r=100*m[0]+10*m[1]+m[2];if(null==b)switch(r){default:return"";case 0:return"";
case 1:return"linear";case 100:case 10:return"bent";case 111:case 201:return"T-shaped";case 30:case 120:case 210:case 300:return 162<Math.abs(JU.Measure.computeTorsion(c[0],a,c[1],c[2],!0))?"trigonal planar":"trigonal pyramidal";case 330:return 1==n%2?"tetrahedral":"uncapped trigonal pyramid";case 60:case 150:case 240:return"tetrahedral";case 402:return"square planar";case 411:case 501:return"see-saw";case 631:return"trigonal bipyramidal";case 802:return"uncapped square pyramid";case 1203:return"octahedral"}switch(r){default:return null;
case 201:break;case 210:case 330:case 411:case 631:if(!f)return null;break;case 300:case 402:case 501:case 802:case 1203:if(f)return null}if(k)if(f)switch(m[1]){case 0:b.sub2(c[z[j[0][0]][0]],a);d.sub2(c[z[j[0][0]][1]],a);b.cross(b,d);b.normalize();4==e&&b.scale(-1);m=this.findNotAttached(h,z,j[2],m[2]);y=m.nextSetBit(0);d.sub2(c[y],a);d.normalize();d.scale(0.5);b.scaleAdd2(JM.AtomCollection.sqrt3_2,b,d);e=-1;break;case 1:4==e?(d=z[j[1][0]],b.add2(c[d[0]],c[d[1]]),b.scaleAdd2(-2,a,b),e=-1):(m=this.findNotAttached(h,
z,j[1],m[1]),e=m.nextSetBit(0));break;default:m=this.findNotAttached(h,z,j[1],m[1]),e=m.nextSetBit(0)}else{r=!1;if(4==h)switch(m[2]){case 1:m=this.findNotAttached(h,z,j[2],m[2]);y=m.nextSetBit(0);e=4==e?y:m.nextSetBit(y+1);break;default:r=!0}else{m=this.findNotAttached(h,z,j[2],m[2]);y=m.nextSetBit(0);for(p=h;p<e&&0<=y;p++)y=m.nextSetBit(y+1);-1==y?r=!0:e=y}r&&(b.sub2(c[z[j[0][0]][0]],a),d.sub2(c[z[j[0][0]][1]],a),b.cross(b,d),4==e&&b.scale(-1),e=-1)}0<=e&&b.sub2(c[e],a);k&&b.scale(-1);b.normalize();
return f?"dsp3":"d2sp3"},"~N,JU.V3,JU.V3,~S");c(c$,"getAttached",function(a,b,d,c){var f=a.getCovalentBondCount();if(f>b)return null;b=Array(f);if(0<f){for(var f=a.bonds,e=0,h=0;h<f.length;h++)if(f[h].isCovalent()){var k=f[h].getOtherAtom(a);if(!c||1!=k.getAtomicAndIsotopeNumber())b[e++]=k}d&&!c&&java.util.Arrays.sort(b,P(JM.AtomCollection.AtomSorter,this,null))}return b},"JM.Atom,~N,~B,~B");c(c$,"findNotAttached",function(a,b,d,c){var f=JU.BS.newN(a);f.setBits(0,a);for(var e=0;e<a;e++)for(var h=
0;h<c;h++){var k=b[d[h]];(k[0]==e||k[1]==e)&&f.clear(e)}return f},"~N,~A,~A,~N");c(c$,"getAtomBitsMDa",function(a,b,d){var c=n(b,Integer)?b.intValue():0;switch(a){case 1086326786:case 1086326785:var f=1086326785==a,e=","+b+",";for(a=this.ac;0<=--a;)null!=this.at[a]&&(b=f?this.at[a].getAtomType():this.at[a].getAtomName(),0<=e.indexOf(","+b+",")&&d.set(a));return d;case 1094715393:for(a=this.ac;0<=--a;)null!=this.at[a]&&this.at[a].getAtomNumber()==c&&d.set(a);return d;case 2097155:for(a=this.ac;0<=
--a;)null!=this.at[a]&&0<this.at[a].getCovalentBondCount()&&d.set(a);return d;case 2097188:case 2097156:case 136314895:case 2097166:case 2097168:case 2097170:case 2097172:case 2097174:case 2097184:return this.haveBioModels?this.bioModelset.getAtomBitsBS(a,null,d):d;case 1612709900:c=1;case 1094715402:for(a=this.ac;0<=--a;)null!=this.at[a]&&this.at[a].getElementNumber()==c&&d.set(a);return d;case 1612709894:for(a=this.ac;0<=--a;)null!=this.at[a]&&this.at[a].isHetero()&&d.set(a);return d;case 1073741824:return this.getIdentifierOrNull(b);
case 2097165:for(a=this.ac;0<=--a;)null!=this.at[a]&&this.at[a].isLeadAtom()&&d.set(a);return d;case 1094713362:case 1639976963:return this.haveBioModels?this.bioModelset.getAtomBitsBS(a,b,d):d;case 1094715412:for(a=this.ac;0<=--a;)null!=this.at[a]&&this.at[a].getResno()==c&&d.set(a);return d;case 1612709912:b=B(2,0);for(a=this.ac;0<=--a;)if(null!=this.at[a])if(c=this.at[a].group.groupID,42<=c&&45>c)d.set(a);else if(8==(f=this.at[a]).getElementNumber()&&2==f.getCovalentBondCount()){for(var c=f.bonds,
h=0,k=c.length;0<=--k&&3>h;)if(c[k].isCovalent()&&1==(e=c[k].getOtherAtom(f)).getElementNumber())b[h++%2]=e.i;2==h&&(d.set(b[1]),d.set(b[0]),d.set(a))}return d;case 1073742355:for(a=this.ac;0<=--a;)null!=this.at[a]&&this.isAltLoc(this.at[a].altloc,b)&&d.set(a);return d;case 1073742356:f=b.toUpperCase();0<=f.indexOf("\\?")&&(f=JU.PT.rep(f,"\\?","\u0001"));(e=f.startsWith("?*"))&&(f=f.substring(1));for(a=this.ac;0<=--a;)null!=this.at[a]&&this.isAtomNameMatch(this.at[a],f,e,e)&&d.set(a);return d;case 1073742357:return JU.BSUtil.copy(this.getChainBits(c));
case 1073742360:return this.getSpecName(b);case 1073742361:for(a=this.ac;0<=--a;)null!=this.at[a]&&this.at[a].group.groupID==c&&d.set(a);return d;case 1073742362:return JU.BSUtil.copy(this.getSeqcodeBits(c,!0));case 5:for(a=this.ac;0<=--a;)null!=this.at[a]&&this.at[a].group.getInsCode()==c&&d.set(a);return d;case 1296041986:for(a=this.ac;0<=--a;)null!=this.at[a]&&this.at[a].getSymOp()==c&&d.set(a);return d}e=b.nextSetBit(0);if(0>e)return d;switch(a){case 1094717454:f=JU.BSUtil.copy(b);for(a=e;0<=
a;a=f.nextSetBit(a+1))d.or(this.am[this.at[a].mi].bsAtoms),f.andNot(d);return d;case 1086326788:f=JU.BSUtil.copy(b);for(a=e;0<=a;a=f.nextSetBit(a+1))this.at[a].group.chain.setAtomBits(d),f.andNot(d);return d;case 1086326789:f=new JU.BS;for(a=e;0<=a;a=b.nextSetBit(a+1))f.set(this.at[a].getElementNumber());for(a=this.ac;0<=--a;)null!=this.at[a]&&f.get(this.at[a].getElementNumber())&&d.set(a);return d;case 1086324742:f=JU.BSUtil.copy(b);for(a=e;0<=a;a=f.nextSetBit(a+1))this.at[a].group.setAtomBits(d),
f.andNot(d);return d;case 1094713366:f=new JU.BS;for(a=e;0<=a;a=b.nextSetBit(a+1))f.set(this.at[a].atomSite);for(a=this.ac;0<=--a;)null!=this.at[a]&&f.get(this.at[a].atomSite)&&d.set(a);return d}JU.Logger.error("MISSING getAtomBits entry for "+JS.T.nameOf(a));return d},"~N,~O,JU.BS");c(c$,"getChainBits",function(a){var b=this.vwr.getBoolean(603979822);b?97<=a&&122>=a&&(a+=159):0<=a&&300>a&&(a=this.chainToUpper(a));for(var d=new JU.BS,c=JU.BS.newN(this.ac),f,e=c.nextClearBit(0);e<this.ac;e=c.nextClearBit(e+
1))if(null!=this.at[e]){var h=this.at[e].group.chain;a==(f=h.chainID)||!b&&0<=f&&300>f&&a==this.chainToUpper(f)?(h.setAtomBits(d),c.or(d)):h.setAtomBits(c)}return d},"~N");c(c$,"chainToUpper",function(a){return 97<=a&&122>=a?a-32:256<=a&&300>a?a-191:a},"~N");c(c$,"isAltLoc",function(a,b){if(null==b)return"\x00"==a;if(1!=b.length)return!1;var d=b.charAt(0);return"*"==d||"?"==d&&"\x00"!=a||a==d},"~S,~S");c(c$,"getSeqcodeBits",function(a,b){var d=new JU.BS,c=JM.Group.getSeqNumberFor(a),f=2147483647!=
c,e=!0,h=JM.Group.getInsertionCodeChar(a);switch(h){case "?":for(var k=this.ac;0<=--k;)if(null!=this.at[k]){var j=this.at[k].group.seqcode;if((!f||c==JM.Group.getSeqNumberFor(j))&&0!=JM.Group.getInsertionCodeFor(j))d.set(k),e=!1}break;default:for(k=this.ac;0<=--k;)if(null!=this.at[k]&&(j=this.at[k].group.seqcode,a==j||!f&&a==JM.Group.getInsertionCodeFor(j)||"*"==h&&c==JM.Group.getSeqNumberFor(j)))d.set(k),e=!1}return!e||b?d:null},"~N,~B");c(c$,"getIdentifierOrNull",function(a){var b=this.getSpecNameOrNull(a,
!1);0<=a.indexOf("\\?")&&(a=JU.PT.rep(a,"\\?","\u0001"));return null!=b||0<a.indexOf("?")?b:0<a.indexOf("*")?this.getSpecNameOrNull(a,!0):this.haveBioModels?this.bioModelset.getIdentifierOrNull(a):null},"~S");c(c$,"getSpecName",function(a){var b=this.getSpecNameOrNull(a,!1);if(null!=b)return b;0<a.indexOf("*")&&(b=this.getSpecNameOrNull(a,!0));return null==b?new JU.BS:b},"~S");c(c$,"getSpecNameOrNull",function(a,b){var d=null;a=a.toUpperCase();0<=a.indexOf("\\?")&&(a=JU.PT.rep(a,"\\?","\u0001"));
var c=a.startsWith("?*");c&&(a=a.substring(1));for(var f=this.ac;0<=--f;)if(null!=this.at[f]){var e=this.at[f].getGroup3(!0);if(null!=e&&0<e.length){if(JU.PT.isMatch(e,a,b,!0)){null==d&&(d=JU.BS.newN(f+1));for(d.set(f);0<=--f&&this.at[f].getGroup3(!0).equals(e);)d.set(f);f++}}else this.isAtomNameMatch(this.at[f],a,b,c)&&(null==d&&(d=JU.BS.newN(f+1)),d.set(f))}return d},"~S,~B");c(c$,"isAtomNameMatch",function(a,b,d,c){return JU.PT.isMatch(a.getAtomName().toUpperCase(),b,d,c)},"JM.Atom,~S,~B,~B");
c(c$,"getAtomIndices",function(a){for(var b=0,d=B(this.ac,0),c=a.nextSetBit(0);0<=c&&c<this.ac;c=a.nextSetBit(c+1))d[c]=++b;return d},"JU.BS");c(c$,"getAtomsNearPlane",function(a,b){for(var d=new JU.BS,c=this.ac;0<=--c;){var f=this.at[c];if(null!=f){var e=JU.Measure.distanceToPlane(b,f);(0<a&&-0.1<=e&&e<=a||0>a&&0.1>=e&&e>=a||0==a&&0.01>Math.abs(e))&&d.set(f.i)}}return d},"~N,JU.P4");c(c$,"clearVisibleSets",function(){this.haveBSClickable=this.haveBSVisible=!1});c(c$,"getAtomsInFrame",function(a){this.clearVisibleSets();
a.clearAll();for(var b=this.ac;0<=--b;)null!=this.at[b]&&this.at[b].isVisible(1)&&a.set(b)},"JU.BS");c(c$,"getVisibleSet",function(a){if(a)this.vwr.setModelVisibility(),this.vwr.shm.finalizeAtoms(null,!0);else if(this.haveBSVisible)return this.bsVisible;this.bsVisible.clearAll();for(a=this.ac;0<=--a;)null!=this.at[a]&&this.at[a].checkVisible()&&this.bsVisible.set(a);null!=this.vwr.shm.bsSlabbedInternal&&this.bsVisible.andNot(this.vwr.shm.bsSlabbedInternal);this.haveBSVisible=!0;return this.bsVisible},
"~B");c(c$,"getClickableSet",function(a){if(a)this.vwr.setModelVisibility();else if(this.haveBSClickable)return this.bsClickable;this.bsClickable.clearAll();for(a=this.ac;0<=--a;)null!=this.at[a]&&this.at[a].isClickable()&&this.bsClickable.set(a);this.haveBSClickable=!0;return this.bsClickable},"~B");c(c$,"isModulated",function(a){return null!=this.bsModulated&&this.bsModulated.get(a)},"~N");c(c$,"deleteModelAtoms",function(a,b,d){this.at=JU.AU.deleteElements(this.at,a,b);this.ac=this.at.length;for(var c=
a;c<this.ac;c++)this.at[c].i=c,this.at[c].mi--;null!=this.bsModulated&&JU.BSUtil.deleteBits(this.bsModulated,d);this.deleteAtomTensors(d);this.atomNames=JU.AU.deleteElements(this.atomNames,a,b);this.atomTypes=JU.AU.deleteElements(this.atomTypes,a,b);this.atomResnos=JU.AU.deleteElements(this.atomResnos,a,b);this.atomSerials=JU.AU.deleteElements(this.atomSerials,a,b);this.atomSeqIDs=JU.AU.deleteElements(this.atomSeqIDs,a,b);this.dssrData=JU.AU.deleteElements(this.dssrData,a,b);this.bfactor100s=JU.AU.deleteElements(this.bfactor100s,
a,b);this.hasBfactorRange=!1;this.occupancies=JU.AU.deleteElements(this.occupancies,a,b);this.resetPartialCharges();this.atomTensorList=JU.AU.deleteElements(this.atomTensorList,a,b);this.vibrations=JU.AU.deleteElements(this.vibrations,a,b);this.nSurfaceAtoms=0;this.surfaceDistance100s=this.bsSurface=null;if(null!=this.tainted)for(a=0;17>a;a++)JU.BSUtil.deleteBits(this.tainted[a],d)},"~N,~N,JU.BS");c(c$,"getAtomIdentityInfo",function(a,b,d){b.put("_ipt",Integer.$valueOf(a));b.put("atomIndex",Integer.$valueOf(a));
b.put("atomno",Integer.$valueOf(this.at[a].getAtomNumber()));b.put("info",this.getAtomInfo(a,null,d));b.put("sym",this.at[a].getElementSymbol())},"~N,java.util.Map,JU.P3");c(c$,"getAtomTensorList",function(a){return 0>a||null==this.atomTensorList||a>=this.atomTensorList.length?null:this.atomTensorList[a]},"~N");c(c$,"deleteAtomTensors",function(a){if(null!=this.atomTensors){for(var b=new JU.Lst,d,c=this.atomTensors.keySet().iterator();c.hasNext()&&((d=c.next())||1);){for(var f=this.atomTensors.get(d),
e=f.size();0<=--e;){var h=f.get(e);(a.get(h.atomIndex1)||0<=h.atomIndex2&&a.get(h.atomIndex2))&&f.removeItemAt(e)}0==f.size()&&b.addLast(d)}for(e=b.size();0<=--e;)this.atomTensors.remove(b.get(e))}},"JU.BS");c(c$,"setCapacity",function(a){this.atomCapacity+=a},"~N");c(c$,"setAtomTensors",function(a,b){if(!(null==b||0==b.size())){null==this.atomTensors&&(this.atomTensors=new java.util.Hashtable);null==this.atomTensorList&&(this.atomTensorList=Array(this.at.length));this.atomTensorList=JU.AU.ensureLength(this.atomTensorList,
this.at.length);this.atomTensorList[a]=JM.AtomCollection.getTensorList(b);for(var d=b.size();0<=--d;){var c=b.get(d);c.atomIndex1=a;c.atomIndex2=-1;c.modelIndex=this.at[a].mi;this.addTensor(c,c.type);null!=c.altType&&this.addTensor(c,c.altType)}}},"~N,JU.Lst");c(c$,"addTensor",function(a,b){b=b.toLowerCase();var d=this.atomTensors.get(b);null==d&&(this.atomTensors.put(b,d=new JU.Lst),d.ensureCapacity(this.atomCapacity));d.addLast(a)},"JU.Tensor,~S");c$.getTensorList=c(c$,"getTensorList",function(a){for(var b=
-1,d=!1,c=a.size(),f=c;0<=--f;){var e=a.get(f);e.forThermalEllipsoid?b=f:2==e.iType&&(d=!0)}var h=Array((0<=b||!d?0:1)+c);if(0<=b&&(h[0]=a.get(b),1==a.size()))return h;if(d){b=0;for(f=c;0<=--f;)e=a.get(f),e.forThermalEllipsoid||(h[++b]=e)}else for(f=0;f<c;f++)h[f]=a.get(f);return h},"JU.Lst");c(c$,"getAtomTensor",function(a,b){var d=this.getAtomTensorList(a);if(null!=d&&null!=b){b=b.toLowerCase();for(var c=0;c<d.length;c++){var f=d[c];if(null!=f&&(b.equals(f.type)||b.equals(f.altType)))return f}}return null},
"~N,~S");c(c$,"getAllAtomTensors",function(a){if(null==this.atomTensors)return null;if(null!=a)return this.atomTensors.get(a.toLowerCase());a=new JU.Lst;for(var b,d=this.atomTensors.entrySet().iterator();d.hasNext()&&((b=d.next())||1);)a.addAll(b.getValue());return a},"~S");c(c$,"scaleVectorsToMax",function(a){if(null!=this.vibrations){for(var b=0,d=JU.BS.newN(this.ac),c=this.vibrations.length;0<=--c;){var f=this.getVibration(c,!1);if(null!=f&&(-1==f.modDim||-2==f.modDim))b=Math.max(b,f.length()),
d.set(c)}if(!(b==a||0==b)){b=a/b;a=!1;for(c=d.nextSetBit(0);0<=c;c=d.nextSetBit(c+1)){var f=this.getVibration(c,!1),e=this.getModulation(c);if(null==e){if(0==b)return;f.scale(b)}else e.scaleVibration(b);a||(this.taintAtom(c,12),a=!0)}this.tainted[12].or(d)}}},"~N");c(c$,"getAtomsFromAtomNumberInFrame",function(a){for(var b=this.vwr.getFrameAtoms(),d=b.nextSetBit(0);0<=d;d=b.nextSetBit(d+1))this.at[d].getAtomNumber()!=a&&b.clear(d);return b},"~N");c(c$,"generateCrystalClass",function(a,b){var d=0>
a||a>=this.ac?null:this.at[a].getUnitCell(),c=null!=b&&Float.isNaN(b.x);return null==d?new JU.Lst:d.generateCrystalClass(c?null:null!=b?b:this.at[a])},"~N,JU.P3");c$.$AtomCollection$AtomSorter$=function(){M(self.c$);c$=t(function(){W(this,arguments);p(this,arguments)},JM.AtomCollection,"AtomSorter",null,java.util.Comparator);j(c$,"compare",function(a,b){return a.i>b.i?1:a.i<b.i?-1:0},"JM.Atom,JM.Atom");c$=L()};E(c$,"almost180",2.984513);c$.sqrt3_2=c$.prototype.sqrt3_2=Math.sqrt(3)/2;c$.vRef=c$.prototype.vRef=
JU.V3.new3(3.14159,2.71828,1.41421);E(c$,"userSettableValues",null,"TAINT_ATOMNAME",0,"TAINT_ATOMTYPE",1,"TAINT_COORD",2,"TAINT_ELEMENT",3,"TAINT_FORMALCHARGE",4,"TAINT_HYDROPHOBICITY",5,"TAINT_BONDINGRADIUS",6,"TAINT_OCCUPANCY",7,"TAINT_PARTIALCHARGE",8,"TAINT_TEMPERATURE",9,"TAINT_VALENCE",10,"TAINT_VANDERWAALS",11,"TAINT_VIBRATION",12,"TAINT_ATOMNO",13,"TAINT_SEQID",14,"TAINT_RESNO",15,"TAINT_CHAIN",16,"TAINT_MAX",17,"CALC_H_DOALL",256,"CALC_H_JUSTC",512,"CALC_H_HAVEH",1024,"CALC_H_QUICK",4,"CALC_H_IGNORE_H",
2048,"CALC_H_ALLOW_H",4096)});s("JM");v(["J.api.AtomIndexIterator"],"JM.AtomIteratorWithinModel",["J.atomdata.RadiusData"],function(){c$=t(function(){this.bspf=this.cubeIterator=null;this.isZeroBased=this.hemisphereOnly=this.threadSafe=!1;this.modelIndex=2147483647;this.atomIndex=-1;this.distanceSquared=this.zeroBase=0;this.bsSelected=null;this.checkGreater=this.isGreaterOnly=!1;this.radiusData=null;this.vdw1=0;this.isVdw=!1;this.vwr=this.atoms=null;this.iNext=0;p(this,arguments)},JM,"AtomIteratorWithinModel",
null,J.api.AtomIndexIterator);q(c$,function(){});c(c$,"initialize",function(a,b,d,c,f,e){this.bspf=a;this.bsSelected=b;this.isGreaterOnly=d;this.isZeroBased=c;this.hemisphereOnly=f;this.threadSafe=e;this.cubeIterator=null},"J.bspt.Bspf,JU.BS,~B,~B,~B,~B");j(c$,"setModel",function(a,b,d,c,f,e,h){this.threadSafe&&(b=-1-b);if(b!=this.modelIndex||null==this.cubeIterator)this.cubeIterator=this.bspf.getCubeIterator(b),this.modelIndex=b;this.zeroBase=this.isZeroBased?d:0;if(-2147483648!=e){this.atomIndex=
0>e?-1:c;if(this.isVdw=null!=h)this.radiusData=h,this.atoms=a.at,this.vwr=a.vwr,e=h.factorType===J.atomdata.RadiusData.EnumType.OFFSET?5+h.value:5*h.value,this.vdw1=this.atoms[c].getVanderwaalsRadiusFloat(this.vwr,h.vdwType);this.checkGreater=this.isGreaterOnly&&2147483647!=c;this.setCenter(f,e)}},"JM.ModelSet,~N,~N,~N,JU.T3,~N,J.atomdata.RadiusData");j(c$,"setCenter",function(a,b){this.setCenter2(a,b)},"JU.T3,~N");c(c$,"setCenter2",function(a,b){null!=this.cubeIterator&&(this.cubeIterator.initialize(a,
b,this.hemisphereOnly),this.distanceSquared=b*b)},"JU.T3,~N");j(c$,"hasNext",function(){return this.hasNext2()});c(c$,"hasNext2",function(){if(0<=this.atomIndex)for(;this.cubeIterator.hasMoreElements();){var a=this.cubeIterator.nextElement();if((this.iNext=a.i)!=this.atomIndex&&(!this.checkGreater||this.iNext>this.atomIndex)&&(null==this.bsSelected||this.bsSelected.get(this.iNext)))return!0}else if(this.cubeIterator.hasMoreElements())return a=this.cubeIterator.nextElement(),this.iNext=a.i,!0;this.iNext=
-1;return!1});j(c$,"next",function(){return this.iNext-this.zeroBase});j(c$,"foundDistance2",function(){return null==this.cubeIterator?-1:this.cubeIterator.foundDistance2()});j(c$,"addAtoms",function(a){for(var b;this.hasNext();)if(0<=(b=this.next())){var d;if(this.isVdw){d=this.atoms[b].getVanderwaalsRadiusFloat(this.vwr,this.radiusData.vdwType)+this.vdw1;switch(this.radiusData.factorType){case J.atomdata.RadiusData.EnumType.OFFSET:d+=2*this.radiusData.value;break;case J.atomdata.RadiusData.EnumType.FACTOR:d*=
this.radiusData.value}d*=d}else d=this.distanceSquared;this.foundDistance2()<=d&&a.set(b)}},"JU.BS");j(c$,"release",function(){null!=this.cubeIterator&&(this.cubeIterator.release(),this.cubeIterator=null)});j(c$,"getPosition",function(){return null})});s("JM");v(["JM.AtomIteratorWithinModel"],"JM.AtomIteratorWithinModelSet",null,function(){c$=t(function(){this.center=this.bsModels=null;this.distance=0;p(this,arguments)},JM,"AtomIteratorWithinModelSet",JM.AtomIteratorWithinModel);q(c$,function(a){I(this,
JM.AtomIteratorWithinModelSet,[]);this.bsModels=a},"JU.BS");j(c$,"setCenter",function(a,b){this.center=a;this.distance=b;this.set(0)},"JU.T3,~N");c(c$,"set",function(a){if(0>(this.modelIndex=this.bsModels.nextSetBit(a))||null==(this.cubeIterator=this.bspf.getCubeIterator(this.modelIndex)))return!1;this.setCenter2(this.center,this.distance);return!0},"~N");j(c$,"hasNext",function(){return this.hasNext2()?!0:!this.set(this.modelIndex+1)?!1:this.hasNext()})});s("JM");v(["JU.Edge","JV.JC"],"JM.Bond",
["JU.C"],function(){c$=t(function(){this.atom2=this.atom1=null;this.shapeVisibilityFlags=this.colix=this.mad=0;p(this,arguments)},JM,"Bond",JU.Edge);q(c$,function(a,b,d,c,f){I(this,JM.Bond,[]);this.atom1=a;this.atom2=b;this.colix=f;this.setOrder(d);this.setMad(c)},"JM.Atom,JM.Atom,~N,~N,~N");c(c$,"setMad",function(a){this.mad=a;this.setShapeVisibility(0!=a)},"~N");c(c$,"setShapeVisibility",function(a){0!=(this.shapeVisibilityFlags&JM.Bond.myVisibilityFlag)!=a&&(this.atom1.addDisplayedBond(JM.Bond.myVisibilityFlag,
a),this.atom2.addDisplayedBond(JM.Bond.myVisibilityFlag,a),this.shapeVisibilityFlags=a?this.shapeVisibilityFlags|JM.Bond.myVisibilityFlag:this.shapeVisibilityFlags&~JM.Bond.myVisibilityFlag)},"~B");c(c$,"getIdentity",function(){return this.index+1+" "+JU.Edge.getBondOrderNumberFromOrder(this.order)+" "+this.atom1.getInfo()+" -- "+this.atom2.getInfo()+" "+this.atom1.distance(this.atom2)});j(c$,"isCovalent",function(){return 0!=(this.order&1023)});j(c$,"isHydrogen",function(){return JU.Edge.isOrderH(this.order)});
c(c$,"isStereo",function(){return 0!=(this.order&1024)});c(c$,"isPartial",function(){return 0!=(this.order&224)});c(c$,"isAromatic",function(){return 0!=(this.order&512)});c(c$,"getEnergy",function(){return 0});c(c$,"getValence",function(){return!this.isCovalent()?0:this.isPartial()||this.is(515)?1:this.order&7});c(c$,"deleteAtomReferences",function(){null!=this.atom1&&this.atom1.deleteBond(this);null!=this.atom2&&this.atom2.deleteBond(this);this.atom1=this.atom2=null});c(c$,"setTranslucent",function(a,
b){this.colix=JU.C.getColixTranslucent3(this.colix,a,b)},"~B,~N");c(c$,"setOrder",function(a){16==this.atom1.getElementNumber()&&16==this.atom2.getElementNumber()&&(a|=256);512==a&&(a=515);this.order=a|this.order&131072},"~N");j(c$,"getAtomIndex1",function(){return this.atom1.i});j(c$,"getAtomIndex2",function(){return this.atom2.i});j(c$,"getCovalentOrder",function(){return JU.Edge.getCovalentBondOrder(this.order)});c(c$,"getOtherAtom",function(a){return this.atom1===a?this.atom2:this.atom2===a?this.atom1:
null},"JM.Atom");c(c$,"is",function(a){return(this.order&-131073)==a},"~N");j(c$,"getOtherNode",function(a){return this.atom1===a?this.atom2:this.atom2===a||null==a?this.atom1:null},"JU.SimpleNode");c(c$,"setAtropisomerOptions",function(a,b){b.get(this.atom1.i);var d,c=2147483647,f=this.atom1.bonds;for(d=0;d<f.length;d++){var e=f[d].getOtherAtom(this.atom1);if(e!==this.atom2)break}if(d<f.length){f=this.atom2.bonds;for(c=0;c<f.length&&!(e=f[c].getOtherAtom(this.atom2),e!==this.atom1);c++);}this.order=
2<d||c>=f.length||2<c?1:JU.Edge.getAtropismOrder(d+1,c+1)},"JU.BS,JU.BS");j(c$,"getCIPChirality",function(){return""},"~B");j(c$,"setCIPChirality",function(){},"~N");j(c$,"toString",function(){return this.atom1+" - "+this.atom2});j(c$,"getAtom",function(a){return 1==a?this.atom2:this.atom1},"~N");c$.myVisibilityFlag=c$.prototype.myVisibilityFlag=JV.JC.getShapeVisibilityFlag(1)});s("JM");v(["JM.AtomCollection"],"JM.BondCollection","JU.AU $.BS JM.Bond $.BondIteratorSelected $.BondSet $.HBond JU.BSUtil $.C $.Edge".split(" "),
function(){c$=t(function(){this.bo=null;this.bondCount=0;this.molecules=this.freeBonds=this.numCached=null;this.defaultCovalentMad=this.moleculeCount=0;this.bsAromatic=this.bsAromaticDouble=this.bsAromaticSingle=null;this.haveAtropicBonds=this.haveHiddenBonds=!1;p(this,arguments)},JM,"BondCollection",JM.AtomCollection);c(c$,"setupBC",function(){this.bsAromatic=new JU.BS;this.numCached=B(5,0);this.freeBonds=Array(5);for(var a=5;0<--a;)this.freeBonds[a]=Array(200);this.setupAC()});c(c$,"releaseModelSetBC",
function(){this.freeBonds=this.bo=null;this.releaseModelSetAC()});c(c$,"getBondIteratorForType",function(a,b){return new JM.BondIteratorSelected(this.bo,this.bondCount,a,b,this.vwr.getBoolean(603979812))},"~N,JU.BS");c(c$,"getBondIterator",function(a){return new JM.BondIteratorSelected(this.bo,this.bondCount,131071,a,!1)},"JU.BS");c(c$,"getBondColix1",function(a){return JU.C.getColixInherited(this.bo[a].colix,this.bo[a].atom1.colixAtom)},"~N");c(c$,"getBondColix2",function(a){return JU.C.getColixInherited(this.bo[a].colix,
this.bo[a].atom2.colixAtom)},"~N");c(c$,"getBondCountInModel",function(a){for(var b=0,d=this.bondCount;0<=--d;)this.bo[d].atom1.mi==a&&b++;return b},"~N");c(c$,"getBondsForSelectedAtoms",function(a,b){for(var d=new JU.BS,c=0;c<this.bondCount;++c){var f=this.bo[c],e=a.get(f.atom1.i),f=a.get(f.atom2.i);(b?e||f:e&&f)&&d.set(c)}return d},"JU.BS,~B");c(c$,"bondAtoms",function(a,b,d,c,f,e,h,k){d=this.getOrAddBond(a,b,d,c,f,e,!0);k&&(d.order|=131072,h&&(a.group=b.group,a.group.addAtoms(a.i)));return d},
"JM.Atom,JM.Atom,~N,~N,JU.BS,~N,~B,~B");c(c$,"getOrAddBond",function(a,b,d,c,f,e,h){if(131071==d||65535==d)d=1;a.isBonded(b)?(a=a.getBond(b).index,h&&(this.bo[a].setOrder(d),this.bo[a].setMad(c),n(this.bo[a],JM.HBond)&&(this.bo[a].energy=e))):(this.bondCount==this.bo.length&&(this.bo=JU.AU.arrayCopyObject(this.bo,this.bondCount+250)),a=this.setBond(this.bondCount++,this.bondMutually(a,b,d,c,e)).index);null!=f&&f.set(a);return this.bo[a]},"JM.Atom,JM.Atom,~N,~N,JU.BS,~N,~B");c(c$,"setBond",function(a,
b){return this.bo[b.index=a]=b},"~N,JM.Bond");c(c$,"bondMutually",function(a,b,d,c,f){d=JU.Edge.isOrderH(d)?new JM.HBond(a,b,d,c,0,f):new JM.Bond(a,b,d,c,0);this.addBondToAtom(a,d);this.addBondToAtom(b,d);return d},"JM.Atom,JM.Atom,~N,~N,~N");c(c$,"addBondToAtom",function(a,b){null==a.bonds?(a.bonds=Array(1),a.bonds[0]=b):a.bonds=this.addToBonds(b,a.bonds)},"JM.Atom,JM.Bond");c(c$,"addToBonds",function(a,b){var d;if(null==b)d=0<this.numCached[1]?this.freeBonds[1][--this.numCached[1]]:Array(1),d[0]=
a;else{var c=b.length;d=c+1;d=5>d&&0<this.numCached[d]?this.freeBonds[d][--this.numCached[d]]:Array(d);d[c]=a;for(var f=c;0<=--f;)d[f]=b[f];5>c&&200>this.numCached[c]&&(this.freeBonds[c][this.numCached[c]++]=b)}return d},"JM.Bond,~A");c(c$,"addHBond",function(a,b,d,c){this.bondCount==this.bo.length&&(this.bo=JU.AU.arrayCopyObject(this.bo,this.bondCount+250));return this.setBond(this.bondCount++,this.bondMutually(a,b,d,1,c)).index},"JM.Atom,JM.Atom,~N,~N");c(c$,"deleteAllBonds2",function(){this.vwr.setShapeProperty(1,
"reset",null);for(var a=this.bondCount;0<=--a;)this.bo[a].deleteAtomReferences(),this.bo[a]=null;this.bondCount=0});c(c$,"getDefaultMadFromOrder",function(a){return JU.Edge.isOrderH(a)?1:32768==a?w(Math.floor(2E3*this.vwr.getFloat(570425406))):this.defaultCovalentMad},"~N");c(c$,"deleteConnections",function(a,b,d,c,f,e,h){var k=0>a,j=0>b,z=k||j;a=this.fixD(a,k);b=this.fixD(b,j);var m=new JU.BS,r=0,n=d|=131072;!h&&JU.Edge.isOrderH(d)&&(d=30720);if(e)e=c;else{e=new JU.BS;for(var y=c.nextSetBit(0);0<=
y;y=c.nextSetBit(y+1)){var p=this.at[y];if(null!=p.bonds)for(var q=p.bonds.length;0<=--q;)f.get(p.getBondedAtomIndex(q))&&e.set(p.bonds[q].index)}}for(y=e.nextSetBit(0);y<this.bondCount&&0<=y;y=e.nextSetBit(y+1))if(c=this.bo[y],this.isInRange(c.atom1,c.atom2,a,b,k,j,z)&&(h||n==(c.order&-257|131072)||0!=(d&c.order&30720)))m.set(y),r++;0<r&&this.deleteBonds(m,!1);return B(-1,[0,r])},"~N,~N,~N,JU.BS,JU.BS,~B,~B");c(c$,"fixD",function(a,b){return b?-a:a*a},"~N,~B");c(c$,"isInRange",function(a,b,d,c,f,
e,h){var k=a.distanceSquared(b);return h?(h=Math.sqrt(k),a=a.getBondingRadius()+b.getBondingRadius(),(f?h>=a*d:k>=d)&&(e?h<=a*c:k<=c)):k>=d&&k<=c},"JM.Atom,JM.Atom,~N,~N,~B,~B,~B");c(c$,"dBb",function(a,b){var d=a.nextSetBit(0);if(!(0>d)){this.resetMolecules();for(var c=-1,f=a.cardinality(),e=d;e<this.bondCount;++e){var h=this.bo[e];if(0<f&&a.get(e)){f--;if(!b){var k=h.atom1.mi;k!=c&&this.am[c=k].resetBoundCount()}h.deleteAtomReferences()}else this.setBond(d++,h)}for(c=this.bondCount;--c>=d;)this.bo[c]=
null;this.bondCount=d;d=this.vwr.getShapeProperty(1,"sets");if(null!=d)for(c=0;c<d.length;c++)JU.BSUtil.deleteBits(d[c],a);JU.BSUtil.deleteBits(this.bsAromatic,a)}},"JU.BS,~B");c(c$,"resetAromatic",function(){for(var a=this.bondCount;0<=--a;){var b=this.bo[a];b.isAromatic()&&b.setOrder(515)}});c(c$,"assignAromaticBondsBs",function(a,b){a||(this.bsAromatic=new JU.BS);this.bsAromaticSingle=new JU.BS;this.bsAromaticDouble=new JU.BS;for(var d=null==b,c=d?this.bondCount-1:b.nextSetBit(0),f=c;0<=f;f=d?
f-1:b.nextSetBit(f+1)){var e=this.bo[f];this.bsAromatic.get(f)&&e.setOrder(515);switch(e.order&-131073){case 515:if(!this.assignAromaticMustBeSingle(e.atom1)&&!this.assignAromaticMustBeSingle(e.atom2)){this.bsAromatic.set(f);break}e.order=513;case 513:this.bsAromaticSingle.set(f);break;case 514:this.bsAromaticDouble.set(f)}}for(var c=(d=null==b)?this.bondCount-1:b.nextSetBit(0),h=new JU.BS,f=c;0<=f;f=d?f-1:b.nextSetBit(f+1))e=this.bo[f],e.is(515)&&(!this.bsAromaticDouble.get(f)&&!this.bsAromaticSingle.get(f))&&
(h.set(f),8==e.atom1.getElementNumber()||8==e.atom2.getElementNumber()?this.assignAromaticDouble(e)||this.assignAromaticSingle(e):h.set(f));for(f=h.nextSetBit(0);0<=f;f=h.nextSetBit(f+1))this.assignAromaticDouble(e=this.bo[f])||this.assignAromaticSingle(e);h=new JU.BS;for(f=c;0<=f;f=d?f-1:b.nextSetBit(f+1))if(e=this.bo[f],this.bsAromaticDouble.get(f))e.is(514)||(this.bsAromatic.set(f),h.set(e.atom1.mi),e.setOrder(514));else if((this.bsAromaticSingle.get(f)||e.isAromatic())&&!e.is(513))this.bsAromatic.set(f),
e.setOrder(513);d=this.am;for(f=h.nextSetBit(0);0<=f;f=h.nextSetBit(f+1))d[f].isBioModel&&(d[f].isPdbWithMultipleBonds=!0);this.assignAromaticNandO(b);this.bsAromaticDouble=this.bsAromaticSingle=null},"~B,JU.BS");c(c$,"assignAromaticDouble",function(a){var b=a.index;if(this.bsAromaticSingle.get(b))return!1;if(this.bsAromaticDouble.get(b))return!0;this.bsAromaticDouble.set(b);return!this.assignAromaticSingleForAtom(a.atom1,b)||!this.assignAromaticSingleForAtom(a.atom2,b)?(this.bsAromaticDouble.clear(b),
!1):!0},"JM.Bond");c(c$,"assignAromaticSingle",function(a){var b=a.index;if(this.bsAromaticDouble.get(b))return!1;if(this.bsAromaticSingle.get(b))return!0;this.bsAromaticSingle.set(b);return!this.assignAromaticDoubleForAtom(a.atom1)||!this.assignAromaticDoubleForAtom(a.atom2)?(this.bsAromaticSingle.clear(b),!1):!0},"JM.Bond");c(c$,"assignAromaticSingleForAtom",function(a,b){var d=a.bonds;if(null==d)return!1;for(var c=d.length;0<=--c;){var f=d[c],e=f.index;if(!(e==b||!f.isAromatic()||this.bsAromaticSingle.get(e)))if(this.bsAromaticDouble.get(e)||
!this.assignAromaticSingle(f))return!1}return!0},"JM.Atom,~N");c(c$,"assignAromaticDoubleForAtom",function(a){a=a.bonds;if(null==a)return!1;for(var b=!1,d=-1,c=a.length;0<=--c;)this.bsAromaticDouble.get(a[c].index)&&(b=!0),a[c].isAromatic()&&(d=c);for(c=a.length;0<=--c;){var f=a[c],e=f.index;if(f.isAromatic()&&!this.bsAromaticDouble.get(e)&&!this.bsAromaticSingle.get(e))if(!b&&this.assignAromaticDouble(f))b=!0;else if((b||c<d)&&!this.assignAromaticSingle(f))return!1}return b},"JM.Atom");c(c$,"allowAromaticBond",
function(a){if(this.assignAromaticMustBeSingle(a.atom1)||this.assignAromaticMustBeSingle(a.atom2))return!1;switch(a.getCovalentOrder()){case 1:case 2:return 3>=a.atom1.getCovalentBondCount()&&3>=a.atom2.getCovalentBondCount();default:return!1}},"JM.Bond");c(c$,"assignAromaticMustBeSingle",function(a){var b=a.getElementNumber();switch(b){case 6:case 7:case 8:case 16:break;default:return!0}var d=a.getValence();switch(b){case 6:return 4==d;case 7:return a.group.getNitrogenAtom()===a||3==d&&1>a.getFormalCharge();
case 8:return a.group.getCarbonylOxygenAtom()!==a&&2==d&&1>a.getFormalCharge();case 16:return 5==a.group.groupID||2==d&&1>a.getFormalCharge()}return!1},"JM.Atom");c(c$,"assignAromaticNandO",function(a){for(var b,d=null==a,c=d?this.bondCount-1:a.nextSetBit(0);0<=c;c=d?c-1:a.nextSetBit(c+1))if(b=this.bo[c],b.is(513)){var f,e=b.atom2,h,k=e.getElementNumber();7==k||8==k?(h=k,f=e,e=b.atom1,k=e.getElementNumber()):(f=b.atom1,h=f.getElementNumber());if(!(7!=h&&8!=h)){var j=f.getValence();if(!(0>j)){var z=
f.getCovalentBondCount();f=f.getFormalCharge();switch(h){case 7:3==j&&(3==z&&1>f&&6==k&&3==e.getValence())&&b.setOrder(514);break;case 8:1==j&&(0==f&&(14==k||16==k))&&b.setOrder(514)}}}}},"JU.BS");c(c$,"getAtomBitsMDb",function(a,b){var d=new JU.BS;switch(a){default:return this.getAtomBitsMDa(a,b,d);case 1677721602:for(var c=b.nextSetBit(0);0<=c;c=b.nextSetBit(c+1))d.set(this.bo[c].atom1.i),d.set(this.bo[c].atom2.i);return d;case 1073742331:for(c=this.bondCount;0<=--c;)this.bo[c].isAromatic()&&(d.set(this.bo[c].atom1.i),
d.set(this.bo[c].atom2.i));return d}},"~N,~O");c(c$,"removeUnnecessaryBonds",function(a,b){var d=new JU.BS,c=new JU.BS,f=a.bonds;if(null!=f){for(var e=0;e<f.length;e++)f[e].isCovalent()?1==f[e].getOtherAtom(a).getElementNumber()&&d.set(f[e].getOtherAtom(a).i):c.set(f[e].index);0<=c.nextSetBit(0)&&this.deleteBonds(c,!1);b&&d.set(a.i);0<=d.nextSetBit(0)&&this.vwr.deleteAtoms(d,!1)}},"JM.Atom,~B");c(c$,"displayBonds",function(a,b){b||(this.haveHiddenBonds=!0);for(var d=a.nextSetBit(0);0<=d;d=a.nextSetBit(d+
1))d<this.bondCount&&0!=this.bo[d].mad&&this.bo[d].setShapeVisibility(b)},"JM.BondSet,~B");c(c$,"getAtomsConnected",function(a,b,d,c){for(var f=n(c,JM.BondSet),e=f?new JM.BondSet:new JU.BS,h=B(this.ac,0),k,j=30720==d,z=65535==d,m=0;m<this.bondCount;m++){var r=this.bo[m];if(z||r.is(d)||j&&r.isHydrogen())f?e.set(m):(c.get(r.atom1.i)&&(h[k=r.atom2.i]++,e.set(k)),c.get(r.atom2.i)&&(h[k=r.atom1.i]++,e.set(k)))}if(f)return e;d=0==a;for(k=this.ac;0<=--k;)c=h[k],c<a||c>b?e.clear(k):d&&0==c&&e.set(k);return e},
"~N,~N,~N,JU.BS");E(c$,"BOND_GROWTH_INCREMENT",250,"MAX_BONDS_LENGTH_TO_CACHE",5,"MAX_NUM_TO_CACHE",200)});s("JM");N(JM,"BondIterator");s("JM");v(["JM.BondIterator"],"JM.BondIteratorSelected",null,function(){c$=t(function(){this.bonds=null;this.iBond=this.bondType=this.bondCount=0;this.bsSelected=null;this.bondSelectionModeOr=!1;p(this,arguments)},JM,"BondIteratorSelected",null,JM.BondIterator);q(c$,function(a,b,d,c,f){this.bonds=a;this.bondCount=b;this.bondType=d;this.bsSelected=c;this.bondSelectionModeOr=
f},"~A,~N,~N,JU.BS,~B");j(c$,"hasNext",function(){if(131071==this.bondType)return this.iBond=this.bsSelected.nextSetBit(this.iBond),0<=this.iBond&&this.iBond<this.bondCount;for(;this.iBond<this.bondCount;++this.iBond){var a=this.bonds[this.iBond];if(!(65535!=this.bondType&&0==(a.order&this.bondType))&&!(65535==this.bondType&&32768==a.order)){var b=this.bsSelected.get(a.atom1.i),a=this.bsSelected.get(a.atom2.i);if(!this.bondSelectionModeOr&&b&&a||this.bondSelectionModeOr&&(b||a))return!0}}return!1});
j(c$,"nextIndex",function(){return this.iBond});j(c$,"next",function(){return this.bonds[this.iBond++]})});s("JM");v(["JU.BS"],"JM.BondSet",["JU.BSUtil"],function(){c$=t(function(){this.associatedAtoms=null;p(this,arguments)},JM,"BondSet",JU.BS);q(c$,function(){I(this,JM.BondSet,[])});c$.newBS=c(c$,"newBS",function(a,b){var d=new JM.BondSet;JU.BSUtil.copy2(a,d);d.associatedAtoms=b;return d},"JU.BS,~A")});s("JM");v(["JM.Structure"],"JM.Chain",null,function(){c$=t(function(){this.model=null;this.chainNo=
this.chainID=0;this.groups=null;this.selectedGroupCount=this.groupCount=0;p(this,arguments)},JM,"Chain",null,JM.Structure);q(c$,function(a,b,d){this.model=a;this.chainID=b;this.chainNo=d;this.groups=Array(16)},"JM.Model,~N,~N");c(c$,"getIDStr",function(){return 0==this.chainID?"":256>this.chainID?""+String.fromCharCode(this.chainID):this.model.ms.vwr.getChainIDStr(this.chainID)});c(c$,"calcSelectedGroupsCount",function(a){for(var b=this.selectedGroupCount=0;b<this.groupCount;b++)this.groups[b].selectedIndex=
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function(){c$=t(function(){this.chain=null;this.groupIndex=0;this.group1="\x00";this.leadAtomIndex=this.firstAtomIndex=-1;this.lastAtomIndex=0;this.bsAdded=null;this.shapeVisibilityFlags=this.selectedIndex=this.groupID=this.seqcode=0;this.dssrNT=null;p(this,arguments)},JM,"Group",null,JM.Structure);q(c$,function(){});c(c$,"setGroup",function(a,b,d,c,f){this.chain=a;this.seqcode=d;this.firstAtomIndex=c;this.lastAtomIndex=f;null!=b&&0<b.length&&this.setGroupID(b);return this},"JM.Chain,~S,~N,~N,~N");
c(c$,"setGroupID",function(){},"~S");c(c$,"isAdded",function(a){return null!=this.bsAdded&&this.bsAdded.get(a)},"~N");c(c$,"addAtoms",function(a){null==this.bsAdded&&(this.bsAdded=new JU.BS);this.bsAdded.set(a)},"~N");j(c$,"setAtomBits",function(a){a.setBits(this.firstAtomIndex,this.lastAtomIndex+1);null!=this.bsAdded&&a.or(this.bsAdded)},"JU.BS");j(c$,"setAtomBitsAndClear",function(a,b){a.setBits(this.firstAtomIndex,this.lastAtomIndex+1);b.clearBits(this.firstAtomIndex,this.lastAtomIndex+1);null!=
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c(c$,"getStructureId",function(){return""});c(c$,"getBioPolymerIndexInModel",function(){return-1});c(c$,"isCrossLinked",function(){return!1},"JM.Group");c(c$,"getCrossLinkVector",function(){return!1},"JU.Lst,~B,~B");c(c$,"isConnectedPrevious",function(){return!1});c(c$,"getNitrogenAtom",function(){return null});c(c$,"getCarbonylOxygenAtom",function(){return null});c(c$,"fixIndices",function(a,b){this.firstAtomIndex-=a;this.leadAtomIndex-=a;this.lastAtomIndex-=a;null!=this.bsAdded&&JU.BSUtil.deleteBits(this.bsAdded,
b)},"~N,JU.BS");c(c$,"getGroupInfo",function(a,b){var d=new java.util.Hashtable;d.put("groupIndex",Integer.$valueOf(a));d.put("groupID",Short.$valueOf(this.groupID));var c=this.getSeqcodeString();null!=c&&d.put("seqCode",c);d.put("_apt1",Integer.$valueOf(this.firstAtomIndex));d.put("_apt2",Integer.$valueOf(this.lastAtomIndex));null!=this.bsAdded&&d.put("addedAtoms",this.bsAdded);d.put("atomInfo1",this.chain.model.ms.getAtomInfo(this.firstAtomIndex,null,b));d.put("atomInfo2",this.chain.model.ms.getAtomInfo(this.lastAtomIndex,
null,b));d.put("visibilityFlags",Integer.$valueOf(this.shapeVisibilityFlags));return d},"~N,JU.P3");c(c$,"getMinZ",function(a,b){b[0]=2147483647;for(var d=this.firstAtomIndex;d<=this.lastAtomIndex;d++)this.checkMinZ(a[d],b);if(null!=this.bsAdded)for(d=this.bsAdded.nextSetBit(0);0<=d;d=this.bsAdded.nextSetBit(d+1))this.checkMinZ(a[d],b)},"~A,~A");c(c$,"checkMinZ",function(a,b){var d=a.sZ-w(a.sD/2)-2;d<b[0]&&(b[0]=Math.max(1,d))},"JM.Atom,~A");c(c$,"getGroupParameter",function(){return NaN},"~N");c(c$,
"getAtomIndex",function(){return-1},"~S,~N");c(c$,"getBSSideChain",function(){return new JU.BS});j(c$,"toString",function(){return"["+this.getGroup3()+"-"+this.getSeqcodeString()+"]"});c(c$,"isNucleicMonomer",function(){return!1});E(c$,"standardGroupList",null);c$.group3Names=c$.prototype.group3Names=Array(128);E(c$,"specialAtomNames",null,"SEQUENCE_NUMBER_FLAG",128,"INSERTION_CODE_MASK",127,"SEQUENCE_NUMBER_SHIFT",8)});s("JM");v(["JM.Bond"],"JM.HBond",["JU.Logger"],function(){c$=t(function(){this.energy=
0;p(this,arguments)},JM,"HBond",JM.Bond);q(c$,function(a,b,d,c,f,e){I(this,JM.HBond,[a,b,d,c,f]);this.energy=e;JU.Logger.debugging&&JU.Logger.debug("HBond energy = "+e+" #"+this.getIdentity())},"JM.Atom,JM.Atom,~N,~N,~N,~N");c(c$,"getEnergy",function(){return this.energy});c$.getEnergy=c(c$,"getEnergy",function(a,b,d,c){return Math.round(-27888/a- -27888/c+-27888/d- -27888/b)},"~N,~N,~N,~N");E(c$,"QConst",-27888)});s("JM");v(null,"JM.LabelToken","java.lang.Float java.util.Hashtable JU.AU $.Lst $.PT $.SB $.T3 JS.SV $.T JU.Edge JV.JC".split(" "),
function(){c$=t(function(){this.data=this.key=this.text=null;this.tok=0;this.pt=-1;this.ch1="\x00";this.width=0;this.precision=2147483647;this.intAsFloat=this.zeroPad=this.alignLeft=!1;p(this,arguments)},JM,"LabelToken");q(c$,function(){});c(c$,"set",function(a,b){this.text=a;this.pt=b;return this},"~S,~N");c$.isLabelPropertyTok=c(c$,"isLabelPropertyTok",function(a){for(var b=JM.LabelToken.labelTokenIds.length;0<=--b;)if(JM.LabelToken.labelTokenIds[b]==a)return!0;return!1},"~N");c$.compile=c(c$,"compile",
function(a,b,d,c){if(null==b||0==b.length)return null;if(0>b.indexOf("%")||2>b.length)return u(-1,[(new JM.LabelToken).set(b,-1)]);for(var f=0,e=-1,h=b.length;++e<h&&0<=(e=b.indexOf("%",e));)f++;for(var f=Array(2*f+1),k,j=0,e=0;0<=(k=b.indexOf("%",e));)e!=k&&(f[j++]=(new JM.LabelToken).set(b.substring(e,k),-1)),e=f[j++]=(new JM.LabelToken).set(null,k),a.autoCalculate(e.tok,null),e=JM.LabelToken.setToken(a,b,e,h,d.charCodeAt(0),c);e<h&&(f[j++]=(new JM.LabelToken).set(b.substring(e),-1));return f},
"JV.Viewer,~S,~S,java.util.Map");c(c$,"formatLabel",function(a,b,d,c){return null==d||0==d.length?null:JM.LabelToken.formatLabelAtomArray(a,b,JM.LabelToken.compile(a,d,"\x00",null),"\x00",null,c)},"JV.Viewer,JM.Atom,~S,JU.P3");c$.formatLabelAtomArray=c(c$,"formatLabelAtomArray",function(a,b,d,c,f,e){if(null==b)return null;var h="0"<c?null:new JU.SB;if(null!=d)for(var k=0;k<d.length;k++){var j=d[k];if(null==j)break;"0"<c&&j.ch1!=c||(0>=j.tok||null!=j.key?null!=h&&(h.append(j.text),"\x00"!=j.ch1&&h.appendC(j.ch1)):
JM.LabelToken.appendAtomTokenValue(a,b,j,h,f,e))}return null==h?null:h.toString().intern()},"JV.Viewer,JM.Atom,~A,~S,~A,JU.P3");c$.getBondLabelValues=c(c$,"getBondLabelValues",function(){var a=new java.util.Hashtable;a.put("#","");a.put("ORDER","");a.put("TYPE","");a.put("LENGTH",Float.$valueOf(0));a.put("ENERGY",Float.$valueOf(0));return a});c$.formatLabelBond=c(c$,"formatLabelBond",function(a,b,d,c,f,e){c.put("#",""+(b.index+1));c.put("ORDER",""+JU.Edge.getBondOrderNumberFromOrder(b.order));c.put("TYPE",
JU.Edge.getBondOrderNameFromOrder(b.order));c.put("LENGTH",Float.$valueOf(b.atom1.distance(b.atom2)));c.put("ENERGY",Float.$valueOf(b.getEnergy()));JM.LabelToken.setValues(d,c);JM.LabelToken.formatLabelAtomArray(a,b.atom1,d,"1",f,e);JM.LabelToken.formatLabelAtomArray(a,b.atom2,d,"2",f,e);return JM.LabelToken.getLabel(d)},"JV.Viewer,JM.Bond,~A,java.util.Map,~A,JU.P3");c$.formatLabelMeasure=c(c$,"formatLabelMeasure",function(a,b,d,c,f){var e=new java.util.Hashtable;e.put("#",""+(b.index+1));e.put("VALUE",
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2147483647;var j=!1;if(h<c&&"."==b.charAt(h)){++h;if(h<c&&"-"==(k=b.charAt(h)))j=!0,++h;if(h<c&&JU.PT.isDigit(k=b.charAt(h)))d.precision=k.charCodeAt(0)-48,j&&(d.precision=-1-d.precision),++h}if(h<c&&null!=e){var z;for(e=e.keySet().iterator();e.hasNext()&&((z=e.next())||1);)if(b.indexOf(z)==h)return h+(d.key=z).length}if(h<c)switch(k=b.charAt(h++)){case "%":return d.text="%",h;case "[":z=b.indexOf("]",h);if(z<h){h=c;break}h=b.substring(h,z).toLowerCase();h.startsWith("property_")?(d.tok=134221834,
d.data=a.getDataObj(h,null,1)):h.startsWith("validation.")?(d.tok=1073742189,d.data=a.getDataObj("property_"+h.substring(11),null,1)):h.startsWith("unitid")?(d.tok=1073741974,d.data=Integer.$valueOf(JV.JC.getUnitIDFlags(h.substring(6)))):(a=JS.T.getTokenFromName(h),null!=a&&JM.LabelToken.isLabelPropertyTok(a.tok)&&(d.tok=a.tok));h=z+1;break;case "{":z=b.indexOf("}",h);if(z<h){h=c;break}h=b.substring(h,z);d.data=a.getDataObj(h,null,1);null==d.data?(d.data=a.getDataObj(h,null,-1),null!=d.data&&(d.data=
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d.text.length-1),b);if(null==z)System.out.println("?? o is null ??");else if(1==z.size())k=z.get(0).floatValue();else{k=NaN;h="";a=0;for(var m=z.size();a<m;a++)h+=","+z.get(a);1<h.length&&(h=h.substring(1))}}break;case 1715472409:var r=a.ms.getInfo(b.mi,d.data),p=b.i-a.ms.am[b.mi].firstAtomIndex,z=null;if(0<=p)if(n(r,Array))var y=r,z=p<y.length?y[p]:null;else n(r,JU.Lst)&&(z=p<r.size()?JS.SV.oValue(r.get(p)):null);null==z?h="":n(z,Float)?k=z.floatValue():n(z,Integer)?k=z.intValue():n(z,JU.T3)?j=z:
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function(){c$=t(function(){this.ms=this.thisID=null;this.index=0;this.isVisible=!0;this.isTrajectory=this.isHidden=!1;this.$isValid=!0;this.colix=0;this.labelColix=-1;this.mad=0;this.tickInfo=null;this.traceX=-2147483648;this.count=this.traceY=0;this.pts=this.countPlusIndices=null;this.value=0;this.type=this.strMeasurement=this.vwr=this.text=this.units=this.property=this.strFormat=null;this.tainted=!1;this.newUnits=this.renderArc=this.renderAxis=null;this.fixedValue=NaN;this.inFront=this.isPending=
!1;p(this,arguments)},JM,"Measurement");O(c$,function(){this.countPlusIndices=B(5,0)});c(c$,"isTainted",function(){return this.tainted&&!(this.tainted=!1)});c(c$,"setM",function(a,b,d,c,f,e){this.ms=a;this.index=e;this.vwr=a.vwr;this.colix=c;this.strFormat=f;null!=b&&(this.tickInfo=b.tickInfo,this.pts=b.pts,this.mad=b.mad,this.thisID=b.thisID,this.text=b.text,this.property=b.property,this.units=b.units,null==this.property&&"+hz".equals(this.units)&&(this.property="property_J"),null!=this.thisID&&
null!=this.text&&(this.labelColix=this.text.colix));null==this.pts&&(this.pts=Array(4));b=null==b?null:b.countPlusIndices;this.count=null==b?0:b[0];0<this.count&&(System.arraycopy(b,0,this.countPlusIndices,0,this.count+1),this.isTrajectory=a.isTrajectoryMeasurement(this.countPlusIndices));this.value=(this.isPending=Float.isNaN(d))||this.isTrajectory?this.getMeasurement(null):d;this.formatMeasurement(null);return this},"JM.ModelSet,JM.Measurement,~N,~N,~S,~N");c(c$,"setPoints",function(a,b,d,c){this.ms=
a;this.countPlusIndices=b;this.count=b[0];this.pts=null==d?Array(4):d;this.vwr=a.vwr;this.tickInfo=c;return this},"JM.ModelSet,~A,~A,JM.TickInfo");c(c$,"setCount",function(a){this.setCountM(a)},"~N");c(c$,"setCountM",function(a){this.count=this.countPlusIndices[0]=a},"~N");c(c$,"getAtomIndex",function(a){return 0<a&&a<=this.count?this.countPlusIndices[a]:-1},"~N");c(c$,"getAtom",function(a){a=this.countPlusIndices[a];return-1>a?this.pts[-2-a]:this.ms.at[a]},"~N");c(c$,"getLastIndex",function(){return 0<
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c(c$,"refresh",function(a){this.value=this.getMeasurement(a);this.isTrajectory=this.ms.isTrajectoryMeasurement(this.countPlusIndices);this.formatMeasurement(null)},"~A");c(c$,"getMeasurementScript",function(a,b){for(var d=new JU.SB,c=a.equals(" "),f=1;f<=this.count;f++)d.append(1<f?a:" ").append(this.getLabel(f,c,b));return d.toString()},"~S,~B");c(c$,"formatMeasurementAs",function(a,b,d){null!=a&&0==a.length&&(a=null);if(d||!(null!=a&&0!=a.indexOf(this.countPlusIndices[0]+":")))this.strFormat=a,
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return this.formatString(a,this.newUnits,b)},"~S");c$.fixUnits=c(c$,"fixUnits",function(a){return a.equals("nanometers")?"nm":a.equals("picometers")?"pm":a.equals("angstroms")?"\u00c5":a.equals("vanderwaals")||a.equals("vdw")?"%":a},"~S");c(c$,"fixValue",function(a,b){this.checkJ(a);null!=a&&a.startsWith("+")&&(this.isPending||(this.value=Math.abs(this.value)),a=a.substring(1));this.newUnits=a;if(2!=this.count)return this.value;var d=this.value;null==a&&null!=this.property&&(a="");if(null!=a){var c=
a.equals("%");if(null==this.property&&(c||a.endsWith("hz"))){var f=this.getAtomIndex(1),e=this.getAtomIndex(2);if(0<=f&&0<=e){var f=this.getAtom(1),e=this.getAtom(2),h=JM.Measurement.nmrType(a),k=!c&&1==h;this.type=c?"percent":k?"dipoleCouplingConstant":3==h?"NOE or 3JHH":"J-CouplingConstant";3==h?(f=this.vwr.getNMRCalculation().getNOEorJHH(u(-1,[f,null,null,e]),11),null==f?(d=NaN,this.newUnits=a=""):(d=f[1],a=this.newUnits=2==f.length?"noe":"hz")):d=c?d/(f.getVanderwaalsRadiusFloat(this.vwr,J.c.VDW.AUTO)+
e.getVanderwaalsRadiusFloat(this.vwr,J.c.VDW.AUTO)):k?this.vwr.getNMRCalculation().getDipolarConstantHz(f,e):this.vwr.getNMRCalculation().getIsoOrAnisoHz(!0,f,e,a,null);this.$isValid=!Float.isNaN(d);c&&(a="pm")}}if(Float.isNaN(d))return NaN;if(a.equals("hz"))return b?Math.round(10*d)/10:d;if(a.equals("noe"))return b?Math.round(100*d)/100:d;if(a.equals("nm"))return b?Math.round(100*d)/1E3:d/10;if(a.equals("pm"))return b?Math.round(1E3*d)/10:100*d;if(a.equals("au"))return b?Math.round(1E3*(d/0.5291772))/
1E3:d/0.5291772;if(a.endsWith("khz"))return b?Math.round(d/10)/100:d/1E3}return b?Math.round(100*d)/100:d},"~S,~B");c(c$,"checkJ",function(a){null!=this.property||(null!=a||null!=this.units)||(a=this.vwr.g.measureDistanceUnits,"+hz".equals(a)&&(this.property="property_J",this.units=a))},"~S");c$.nmrType=c(c$,"nmrType",function(a){return 0>a.indexOf("hz")?0:a.equals("noe_hz")?3:a.startsWith("dc_")||a.equals("khz")?1:2},"~S");c(c$,"formatAngle",function(a){var b=this.getLabelString();0<=b.indexOf("%V")&&
(a=Math.round(10*a)/10);return this.formatString(a,"\u00b0",b)},"~N");c(c$,"getLabelString",function(){var a=this.countPlusIndices[0]+":",b=null;if(null!=this.strFormat){if(0==this.strFormat.length)return null;b=2<this.strFormat.length&&0==this.strFormat.indexOf(a)?this.strFormat:null}null==b&&(this.strFormat=null,b=this.vwr.getDefaultMeasurementLabel(this.countPlusIndices[0]));0==b.indexOf(a)&&(b=b.substring(2));null==this.strFormat&&(this.strFormat=a+b);return b});c(c$,"formatString",function(a,
b,d){return JM.LabelToken.formatLabelMeasure(this.vwr,this,d,a,b)},"~N,~S,~S");c(c$,"sameAsPoints",function(a,b){if(this.count!=a[0])return!1;for(var d=!0,c=1;c<=this.count&&d;c++)d=this.countPlusIndices[c]==a[c];if(d)for(c=0;c<this.count&&d;c++)null!=b[c]&&(d=0.01>this.pts[c].distance(b[c]));if(d)return!0;switch(this.count){default:return!0;case 2:return this.sameAsIJ(a,b,1,2)&&this.sameAsIJ(a,b,2,1);case 3:return this.sameAsIJ(a,b,1,3)&&this.sameAsIJ(a,b,2,2)&&this.sameAsIJ(a,b,3,1);case 4:return this.sameAsIJ(a,
b,1,4)&&this.sameAsIJ(a,b,2,3)&&this.sameAsIJ(a,b,3,2)&&this.sameAsIJ(a,b,4,1)}},"~A,~A");c(c$,"sameAsIJ",function(a,b,d,c){d=this.countPlusIndices[d];a=a[c];return 0<=d||0<=a?d==a:0.01>this.pts[-2-d].distance(b[-2-a])},"~A,~A,~N,~N");c(c$,"sameAs",function(a,b){return this.sameAsIJ(this.countPlusIndices,this.pts,a,b)},"~N,~N");c(c$,"getPropMeasurement",function(a){if(null==this.countPlusIndices||2!=this.count)return NaN;for(var b=this.count;0<=--b;)if(0>this.countPlusIndices[b+1])return NaN;try{var d=
null==a?this.getAtom(1):a[0],c=null==a?this.getAtom(2):a[1],f=this.vwr.getDataObj(this.property,null,2),e=d.i,h=c.i;return null==f||h>=f.length||e>=f.length?NaN:f[e][h]}catch(k){return NaN}},"~A");c(c$,"getMeasurement",function(a){this.checkJ(null);if(!Float.isNaN(this.fixedValue))return this.fixedValue;if(null!=this.property)return this.getPropMeasurement(a);if(null==this.countPlusIndices||2>this.count)return NaN;for(var b=this.count;0<=--b;)if(-1==this.countPlusIndices[b+1])return NaN;var b=null==
a?this.getAtom(1):a[0],d=null==a?this.getAtom(2):a[1],c;switch(this.count){case 2:return b.distance(d);case 3:return c=null==a?this.getAtom(3):a[2],JU.Measure.computeAngleABC(b,d,c,!0);case 4:return c=null==a?this.getAtom(3):a[2],a=null==a?this.getAtom(4):a[3],JU.Measure.computeTorsion(b,d,c,a,!0);default:return NaN}},"~A");c(c$,"getLabel",function(a,b,d){var c=this.countPlusIndices[a];return 0>c?(d?"modelIndex "+this.getAtom(a).mi+" ":"")+JU.Escape.eP(this.getAtom(a)):b?"({"+c+"})":this.vwr.getAtomInfo(c)},
"~N,~B,~B");c(c$,"setModelIndex",function(a){if(null!=this.pts)for(var b=0;b<this.count;b++)null!=this.pts[b]&&(this.pts[b].mi=a)},"~N");c(c$,"isValid",function(){return!(this.sameAs(1,2)||2<this.count&&this.sameAs(1,3)||4==this.count&&this.sameAs(2,4))});c$.find=c(c$,"find",function(a,b){for(var d=b.countPlusIndices,c=b.pts,f=a.size();0<=--f;)if(a.get(f).sameAsPoints(d,c))return f;return-1},"JU.Lst,JM.Measurement");c(c$,"isConnected",function(a,b){for(var d=-1,c=1;c<=b;c++){var f=this.getAtomIndex(c);
if(!(0>f)){if(0<=d&&!a[f].isBonded(a[d]))return!1;d=f}}return!0},"~A,~N");c(c$,"getInfoAsString",function(a){var b=this.fixValue(a,!0);a=new JU.SB;a.append(2==this.count?null!=this.property?this.property:null==this.type?"distance":this.type:3==this.count?"angle":"dihedral");a.append(" \t").appendF(b);a.append(" \t").append(JU.PT.esc(this.strMeasurement));for(b=1;b<=this.count;b++)a.append(" \t").append(this.getLabel(b,!1,!1));null!=this.thisID&&a.append(" \t").append(this.thisID);return a.toString()},
"~S");c(c$,"isInRange",function(a,b){if(a.factorType===J.atomdata.RadiusData.EnumType.FACTOR){var d=this.getAtom(1),c=this.getAtom(2),d=(d.getVanderwaalsRadiusFloat(this.vwr,a.vdwType)+c.getVanderwaalsRadiusFloat(this.vwr,a.vdwType))*a.value;return b<=d}return 3.4028235E38==a.values[0]||b>=a.values[0]&&b<=a.values[1]},"J.atomdata.RadiusData,~N");c(c$,"isIntramolecular",function(a,b){for(var d=-1,c=1;c<=b;c++){var f=this.getAtomIndex(c);if(!(0>f))if(f=a[f].getMoleculeNumber(!1),0>d)d=f;else if(f!=
d)return!1}return!0},"~A,~N");c(c$,"isMin",function(a){var b=this.getAtom(1),d=this.getAtom(2),c=A(100*d.distanceSquared(b)),b=b.getAtomName(),d=d.getAtomName(),d=0>b.compareTo(d)?b+d:d+b;a=a.get(d);return null!=a&&c==a.intValue()},"java.util.Map");c$.isUnits=c(c$,"isUnits",function(a){return JU.PT.isOneOf((a.startsWith("+")?a.substring(1):a).toLowerCase(),";nm;nanometers;pm;picometers;angstroms;angstroms;ang;\u00c5;au;vanderwaals;vdw;%;noe;")||0>a.indexOf(" ")&&a.endsWith("hz")},"~S");E(c$,"NMR_NOT",
0,"NMR_DC",1,"NMR_JC",2,"NMR_NOE_OR_J",3)});s("JM");v(["J.api.JmolMeasurementClient"],"JM.MeasurementData",["java.lang.Float","JU.BS","$.Lst","JM.Measurement","JU.BSUtil"],function(){c$=t(function(){this.points=this.measurements=this.measurementStrings=this.client=null;this.mustNotBeConnected=this.mustBeConnected=!1;this.tickInfo=null;this.tokAction=12290;this.note=this.property=this.strFormat=this.radiusData=null;this.isAll=!1;this.colix=0;this.intramolecular=null;this.mad=0;this.units=this.text=
this.thisID=null;this.fixedValue=0;this.ms=this.minArray=this.atoms=null;this.allowSelf=!1;this.vwr=null;this.iFirstAtom=0;this.justOneModel=!0;this.htMin=null;p(this,arguments)},JM,"MeasurementData",null,J.api.JmolMeasurementClient);q(c$,function(){});c(c$,"init",function(a,b,d){this.vwr=b;this.points=d;this.thisID=a;return this},"~S,JV.Viewer,JU.Lst");c(c$,"setModelSet",function(a){this.ms=a;return this},"JM.ModelSet");c(c$,"set",function(a,b,d,c,f,e,h,k,j,z,m,r,p,y,q){this.ms=this.vwr.ms;this.tokAction=
a;2<=this.points.size()&&(n(this.points.get(0),JU.BS)&&n(this.points.get(1),JU.BS))&&(this.justOneModel=JU.BSUtil.haveCommon(this.vwr.ms.getModelBS(this.points.get(0),!1),this.vwr.ms.getModelBS(this.points.get(1),!1)));this.htMin=b;this.radiusData=d;this.property=c;this.strFormat=f;this.units=e;this.tickInfo=h;this.mustBeConnected=k;this.mustNotBeConnected=j;this.intramolecular=z;this.isAll=m;this.mad=r;this.colix=p;this.text=y;this.fixedValue=q;return this},"~N,java.util.Map,J.atomdata.RadiusData,~S,~S,~S,JM.TickInfo,~B,~B,Boolean,~B,~N,~N,JM.Text,~N");
c(c$,"processNextMeasure",function(a){var b=a.getMeasurement(null);if(!(null!=this.htMin&&!a.isMin(this.htMin)||null!=this.radiusData&&!a.isInRange(this.radiusData,b)))if(null==this.measurementStrings&&null==this.measurements){var d=this.minArray[this.iFirstAtom];a.value=b;b=a.fixValue(this.units,!1);this.minArray[this.iFirstAtom]=-Infinity==1/d?b:Math.min(d,b)}else null!=this.measurementStrings?this.measurementStrings.addLast(a.getStringUsing(this.vwr,this.strFormat,this.units)):this.measurements.addLast(Float.$valueOf(a.getMeasurement(null)))},
"JM.Measurement");c(c$,"getMeasurements",function(a,b){if(b){this.minArray=K(this.points.get(0).cardinality(),0);for(var d=0;d<this.minArray.length;d++)this.minArray[d]=-0;this.define(null,this.ms);return this.minArray}if(a)return this.allowSelf=!0,this.measurements=new JU.Lst,this.define(null,this.ms),this.measurements;this.measurementStrings=new JU.Lst;this.define(null,this.ms);return this.measurementStrings},"~B,~B");c(c$,"define",function(a,b){this.client=null==a?this:a;this.atoms=b.at;var d=
this.points.size();if(!(2>d)){var c=-1,f=Array(4),e=B(5,0),h=(new JM.Measurement).setPoints(b,e,f,null);h.setCount(d);h.property=this.property;h.strFormat=this.strFormat;h.units=this.units;h.fixedValue=this.fixedValue;for(var k=-1,j=0;j<d;j++){var z=this.points.get(j);if(n(z,JU.BS)){k=z.cardinality();if(0==k)return;1<k&&(c=0);k=j;0==j&&(this.iFirstAtom=0);e[j+1]=z.nextSetBit(0)}else f[j]=z,e[j+1]=-2-j}this.nextMeasure(0,k,h,c)}},"J.api.JmolMeasurementClient,JM.ModelSet");c(c$,"nextMeasure",function(a,
b,d,c){if(a>b)(this.allowSelf&&!this.mustBeConnected&&!this.mustNotBeConnected||d.isValid())&&((!this.mustBeConnected||d.isConnected(this.atoms,a))&&(!this.mustNotBeConnected||!d.isConnected(this.atoms,a))&&(null==this.intramolecular||d.isIntramolecular(this.atoms,a)==this.intramolecular.booleanValue()))&&this.client.processNextMeasure(d);else{var f=this.points.get(a),e=d.countPlusIndices,h=0==a?2147483647:e[a];if(0>h)this.nextMeasure(a+1,b,d,c);else{for(var k=!1,j=f.nextSetBit(0),z=0;0<=j;j=f.nextSetBit(j+
1),z++)if(j!=h||this.allowSelf){var m=this.atoms[j].mi;if(0<=c&&this.justOneModel)if(0==a)c=m;else if(c!=m)continue;e[a+1]=j;0==a&&(this.iFirstAtom=z);k=!0;this.nextMeasure(a+1,b,d,c)}k||this.nextMeasure(a+1,b,d,c)}}},"~N,~N,JM.Measurement,~N")});s("JM");v(["JM.Measurement"],"JM.MeasurementPending",null,function(){c$=t(function(){this.haveModified=this.haveTarget=!1;this.numSet=0;this.lastIndex=-1;p(this,arguments)},JM,"MeasurementPending",JM.Measurement);c(c$,"set",function(a){return this.setM(a,
null,NaN,0,null,0)},"JM.ModelSet");c(c$,"checkPoint",function(a){for(var b=1;b<=this.numSet;b++)if(this.countPlusIndices[b]==-1-b&&0.01>this.pts[b-1].distance(a))return!1;return!0},"JU.Point3fi");c(c$,"getIndexOf",function(a){for(var b=1;b<=this.numSet;b++)if(this.countPlusIndices[b]==a)return b;return 0},"~N");j(c$,"setCount",function(a){this.setCountM(a);this.numSet=a},"~N");c(c$,"addPoint",function(a,b,d){this.haveModified=a!=this.lastIndex;this.lastIndex=a;if(null==b){if(0<this.getIndexOf(a))return d&&
(this.numSet=this.count),this.count;this.haveTarget=0<=a;if(!this.haveTarget)return this.count=this.numSet;this.count=this.numSet+1;this.countPlusIndices[this.count]=a}else{if(!this.checkPoint(b))return d&&(this.numSet=this.count),this.count;a=this.numSet;this.haveModified=this.haveTarget=!0;this.count=this.numSet+1;this.pts[a]=b;this.countPlusIndices[this.count]=-2-a}this.countPlusIndices[0]=this.count;d&&(this.numSet=this.count);this.value=this.getMeasurement(null);this.strFormat=null;this.formatMeasurement(null);
return this.count},"~N,JU.Point3fi,~B")});s("JM");v(["JU.BS","$.SB"],"JM.Model",["java.util.Hashtable","JU.AU","JU.BSUtil","JV.FileManager"],function(){c$=t(function(){this.mat4=this.ms=null;this.fileIndex=this.modelIndex=0;this.isModelKit=this.isPdbWithMultipleBonds=this.isBioModel=!1;this.translation=this.dataFrames=this.biosymmetry=this.properties=this.auxiliaryInfo=this.orientation=this.dssrCache=this.simpleCage=this.chains=null;this.dataSourceFrame=-1;this.loadState="";this.loadScript=null;this.isTrajectory=
this.isJmolDataFrame=this.structureTainted=this.hasRasmolHBonds=!1;this.act=this.insertionCount=this.altLocCount=this.trajectoryBaseIndex=0;this.bondCount=-1;this.chainCount=0;this.groupCount=-1;this.firstMoleculeIndex=this.firstAtomIndex=this.biosymmetryCount=this.moleculeCount=this.hydrogenCount=0;this.bsAtomsDeleted=this.bsAtoms=null;this.frameDelay=this.defaultRotationRadius=0;this.selectedTrajectory=-1;this.bsCheck=this.pdbID=this.jmolFrameType=this.jmolData=null;this.hasChirality=!1;this.isOrderly=
!0;p(this,arguments)},JM,"Model");O(c$,function(){this.chains=Array(8);this.loadScript=new JU.SB;this.bsAtoms=new JU.BS;this.bsAtomsDeleted=new JU.BS});q(c$,function(){});c(c$,"set",function(a,b,d,c,f,e){this.ms=a;this.dataSourceFrame=this.modelIndex=b;this.trajectoryBaseIndex=(this.isTrajectory=0<=d)?d:b;null==e&&(e=new java.util.Hashtable);this.auxiliaryInfo=e;a=e.get("biosymmetryCount");null!=a&&(this.biosymmetryCount=a.intValue(),this.biosymmetry=e.get("biosymmetry"));a=e.get("fileName");null!=
a&&e.put("fileName",JV.FileManager.stripTypePrefix(a));this.properties=f;null==c?this.jmolFrameType="modelSet":(this.jmolData=c,this.isJmolDataFrame=!0,e.put("jmolData",c),e.put("title",c),this.jmolFrameType=0<=c.indexOf("ramachandran")?"ramachandran":0<=c.indexOf("quaternion")?"quaternion":"data");return this},"JM.ModelSet,~N,~N,~S,java.util.Properties,java.util.Map");c(c$,"getTrueAtomCount",function(){return JU.BSUtil.andNot(this.bsAtoms,this.bsAtomsDeleted).cardinality()});c(c$,"isContainedIn",
function(a){null==this.bsCheck&&(this.bsCheck=new JU.BS);this.bsCheck.clearAll();this.bsCheck.or(a);a=JU.BSUtil.andNot(this.bsAtoms,this.bsAtomsDeleted);this.bsCheck.and(a);return this.bsCheck.equals(a)},"JU.BS");c(c$,"resetBoundCount",function(){this.bondCount=-1});c(c$,"getBondCount",function(){if(0<=this.bondCount)return this.bondCount;var a=this.ms.bo;this.bondCount=0;for(var b=this.ms.bondCount;0<=--b;)a[b].atom1.mi==this.modelIndex&&this.bondCount++;return this.bondCount});c(c$,"getChainCount",
function(a){if(1<this.chainCount&&!a)for(a=0;a<this.chainCount;a++)if(0==this.chains[a].chainID)return this.chainCount-1;return this.chainCount},"~B");c(c$,"calcSelectedGroupsCount",function(a){for(var b=this.chainCount;0<=--b;)this.chains[b].calcSelectedGroupsCount(a)},"JU.BS");c(c$,"getGroupCount",function(){if(0>this.groupCount){this.groupCount=0;for(var a=this.chainCount;0<=--a;)this.groupCount+=this.chains[a].groupCount}return this.groupCount});c(c$,"getChainAt",function(a){return a<this.chainCount?
this.chains[a]:null},"~N");c(c$,"getChain",function(a){for(var b=this.chainCount;0<=--b;){var d=this.chains[b];if(d.chainID==a)return d}return null},"~N");c(c$,"resetDSSR",function(a){this.dssrCache=null;a&&this.auxiliaryInfo.remove("dssr")},"~B");c(c$,"fixIndices",function(a,b,d){this.fixIndicesM(a,b,d)},"~N,~N,JU.BS");c(c$,"fixIndicesM",function(a,b,d){this.dataSourceFrame>a&&this.dataSourceFrame--;this.trajectoryBaseIndex>a&&this.trajectoryBaseIndex--;this.firstAtomIndex-=b;for(a=0;a<this.chainCount;a++)this.chains[a].fixIndices(b,
d);JU.BSUtil.deleteBits(this.bsAtoms,d);JU.BSUtil.deleteBits(this.bsAtomsDeleted,d)},"~N,~N,JU.BS");c(c$,"freeze",function(){this.freezeM();return!1});c(c$,"freezeM",function(){for(var a=0;a<this.chainCount;a++)if(0==this.chains[a].groupCount){for(var b=a+1;b<this.chainCount;b++)this.chains[b-1]=this.chains[b];this.chainCount--}this.chains=JU.AU.arrayCopyObject(this.chains,this.chainCount);this.groupCount=-1;this.getGroupCount();for(a=0;a<this.chainCount;++a)this.chains[a].groups=JU.AU.arrayCopyObject(this.chains[a].groups,
this.chains[a].groupCount)})});s("JM");v(["java.util.Hashtable","JU.BS"],"JM.ModelLoader","java.lang.Boolean $.Float $.NullPointerException java.util.Arrays JU.AU $.Lst $.P3 $.PT $.SB $.V3 J.api.Interface JM.Chain $.Group $.Model $.ModelSet JS.T JU.BSUtil $.Elements $.JmolMolecule $.Logger JV.JC".split(" "),function(){c$=t(function(){this.modelSet0=this.ms=this.vwr=null;this.appendNew=this.merging=!1;this.specialAtomIndexes=this.group3Counts=this.group3Lists=this.jmolData=null;this.doAddHydrogens=
this.doMinimize=this.isPyMOLsession=this.isTrajectory=this.isMutate=this.isMOL2D=this.is2D=this.someModelsAreModulated=this.someModelsHaveUnitcells=!1;this.groups=this.jbr=this.fileHeader=null;this.groupCount=0;this.firstAtomIndexes=this.seqcodes=this.group3Of=this.chainOf=this.htAtomMap=this.modulationTUV=null;this.iModel=0;this.model=null;this.currentChainID=0;this.isNewChain=!1;this.currentChain=null;this.currentGroupSequenceNumber=0;this.currentGroupInsertionCode="\x00";this.nullGroup=this.currentGroup3=
null;this.adapterTrajectoryCount=this.adapterModelCount=this.baseTrajectoryCount=this.baseGroupIndex=this.baseAtomIndex=this.baseModelCount=this.baseModelIndex=0;this.modulationOn=this.noAutoBond=!1;this.$mergeGroups=this.appendToModelIndex=this.htGroup1=null;this.iChain=0;this.vStereo=null;this.lastModel=-1;this.structuresDefinedInFile=null;this.stereodir=1;p(this,arguments)},JM,"ModelLoader");O(c$,function(){this.htAtomMap=new java.util.Hashtable;this.structuresDefinedInFile=new JU.BS});q(c$,function(a,
b,d,c,f,e){this.vwr=a;this.ms=new JM.ModelSet(a,b);var h=a.getModelAdapter();this.modelSet0=f;(this.merging=null!=f&&0<f.ac)?this.ms.canSkipLoad=!1:a.resetShapes(!1);this.ms.preserveState=a.getPreserveState();this.ms.showRebondTimes=a.getBoolean(603979934);null==e?(this.initializeInfo(b,null),this.createModelSet(null,null,null),a.setStringProperty("_fileType","")):(this.ms.preserveState||(this.ms.canSkipLoad=!1),a=h.getAtomSetCollectionAuxiliaryInfo(c),a.put("loadScript",d),this.initializeInfo(h.getFileTypeName(c).toLowerCase().intern(),
a),this.createModelSet(h,c,e),null!=this.jbr&&this.jbr.setLoader(null),this.jbr=null)},"JV.Viewer,~S,JU.SB,~O,JM.ModelSet,JU.BS");c(c$,"initializeInfo",function(a,b){this.ms.g3d=this.vwr.gdata;this.ms.modelSetTypeName=a;this.ms.isXYZ="xyz"===a;this.ms.msInfo=b;this.ms.modelSetProperties=this.ms.getInfoM("properties");this.ms.haveBioModels=this.ms.getMSInfoB("isPDB");this.isMutate=this.ms.getMSInfoB("isMutate");this.ms.haveBioModels&&(this.jbr=this.vwr.getJBR().setLoader(this));this.jmolData=0==this.adapterModelCount?
this.ms.getInfoM("jmolData"):null;this.fileHeader=this.ms.getInfoM("fileHeader");var d=this.ms.getInfoM("trajectorySteps");if(this.isTrajectory=null!=d)this.ms.trajectory=this.newTrajectory(this.ms,d);this.isPyMOLsession=this.ms.getMSInfoB("isPyMOL");this.doAddHydrogens=null!=this.jbr&&!this.isTrajectory&&!this.isPyMOLsession&&!this.ms.getMSInfoB("pdbNoHydrogens")&&(this.ms.getMSInfoB("pdbAddHydrogens")||this.vwr.getBoolean(603979894));null!=b&&(b.remove("pdbNoHydrogens"),b.remove("pdbAddHydrogens"),
b.remove("trajectorySteps"),this.isTrajectory&&(this.ms.vibrationSteps=b.remove("vibrationSteps")),b.containsKey("legacyJavaFloat")&&this.vwr.setBooleanProperty("legacyJavaFloat",!0));this.htGroup1=this.ms.getInfoM("htGroup1");d=this.ms.getInfoM("modulationOn");null!=d&&(this.modulationOn=!0,this.modulationTUV=d===Boolean.TRUE?null:d);this.noAutoBond=this.ms.getMSInfoB("noAutoBond");this.doMinimize=(this.is2D=this.ms.getMSInfoB("is2D"))&&this.ms.getMSInfoB("doMinimize");this.adapterTrajectoryCount=
this.isTrajectory?this.ms.trajectory.steps.size():0;this.ms.someModelsHaveSymmetry=this.ms.getMSInfoB("someModelsHaveSymmetry");this.someModelsHaveUnitcells=this.ms.getMSInfoB("someModelsHaveUnitcells");this.someModelsAreModulated=this.ms.getMSInfoB("someModelsAreModulated");this.ms.someModelsHaveFractionalCoordinates=this.ms.getMSInfoB("someModelsHaveFractionalCoordinates");this.merging&&(this.ms.haveBioModels=(new Boolean(this.ms.haveBioModels|this.modelSet0.haveBioModels)).valueOf(),this.ms.bioModelset=
this.modelSet0.bioModelset,null!=this.ms.bioModelset&&this.ms.bioModelset.set(this.vwr,this.ms),this.ms.someModelsHaveSymmetry=(new Boolean(this.ms.someModelsHaveSymmetry|this.modelSet0.getMSInfoB("someModelsHaveSymmetry"))).valueOf(),this.someModelsHaveUnitcells=(new Boolean(this.someModelsHaveUnitcells|this.modelSet0.getMSInfoB("someModelsHaveUnitcells"))).valueOf(),this.ms.someModelsHaveFractionalCoordinates=(new Boolean(this.ms.someModelsHaveFractionalCoordinates|this.modelSet0.getMSInfoB("someModelsHaveFractionalCoordinates"))).valueOf(),
this.ms.someModelsHaveAromaticBonds=(new Boolean(this.ms.someModelsHaveAromaticBonds|this.modelSet0.someModelsHaveAromaticBonds)).valueOf(),this.ms.msInfo.put("someModelsHaveSymmetry",Boolean.$valueOf(this.ms.someModelsHaveSymmetry)),this.ms.msInfo.put("someModelsHaveUnitcells",Boolean.$valueOf(this.someModelsHaveUnitcells)),this.ms.msInfo.put("someModelsHaveFractionalCoordinates",Boolean.$valueOf(this.ms.someModelsHaveFractionalCoordinates)),this.ms.msInfo.put("someModelsHaveAromaticBonds",Boolean.$valueOf(this.ms.someModelsHaveAromaticBonds)))},
"~S,java.util.Map");c(c$,"newTrajectory",function(a,b){return J.api.Interface.getInterface("JM.Trajectory",this.vwr,"load").set(this.vwr,a,b)},"JM.ModelSet,JU.Lst");c(c$,"getGroup3",function(a){return a>=this.group3Of.length?null:this.group3Of[a]},"~N");c(c$,"getFirstAtomIndex",function(a){return this.firstAtomIndexes[a]},"~N");c(c$,"getAtomCount",function(){return this.ms.ac});c(c$,"createModelSet",function(a,b,d){var c=null==a?0:a.getAtomCount(b);0<c&&JU.Logger.info("reading "+c+" atoms");this.adapterModelCount=
null==a?1:a.getAtomSetCount(b);this.appendToModelIndex=null==this.ms.msInfo?null:this.ms.msInfo.get("appendToModelIndex");this.appendNew=!this.isMutate&&(!this.merging||null==a||1<this.adapterModelCount||this.isTrajectory||this.vwr.getBoolean(603979792)&&null==this.appendToModelIndex);this.htAtomMap.clear();this.chainOf=Array(32);this.group3Of=Array(32);this.seqcodes=B(32,0);this.firstAtomIndexes=B(32,0);this.currentChainID=2147483647;this.currentChain=null;this.currentGroupInsertionCode="\uffff";
this.currentGroup3="xxxxx";this.iModel=-1;this.model=null;this.merging&&this.mergeTrajAndVib(this.modelSet0,this.ms);this.initializeAtomBondModelCounts(c);null!=d&&(this.doMinimize||this.is2D)&&d.setBits(this.baseAtomIndex,this.baseAtomIndex+c);null==a?this.setModelNameNumberProperties(0,-1,"",1,null,null,null):(0<this.adapterModelCount&&(JU.Logger.info("ModelSet: haveSymmetry:"+this.ms.someModelsHaveSymmetry+" haveUnitcells:"+this.someModelsHaveUnitcells+" haveFractionalCoord:"+this.ms.someModelsHaveFractionalCoordinates),
JU.Logger.info(this.adapterModelCount+" model"+(1==this.ms.mc?"":"s")+' in this collection. Use getProperty "modelInfo" or getProperty "auxiliaryInfo" to inspect them.')),d=this.ms.getInfoM("defaultOrientationQuaternion"),null!=d&&(JU.Logger.info("defaultOrientationQuaternion = "+d),JU.Logger.info('Use "set autoLoadOrientation TRUE" before loading or "restore orientation DEFAULT" after loading to view this orientation.')),this.iterateOverAllNewModels(a,b),this.iterateOverAllNewAtoms(a,b),this.iterateOverAllNewBonds(a,
b),this.merging&&!this.appendNew&&(d=a.getAtomSetAuxiliaryInfo(b,0),this.ms.setInfo(this.baseModelIndex,"initialAtomCount",d.get("initialAtomCount")),this.ms.setInfo(this.baseModelIndex,"initialBondCount",d.get("initialBondCount"))),this.initializeUnitCellAndSymmetry(),this.initializeBonding());this.finalizeGroupBuild();this.is2D&&this.doMinimize&&this.applyStereochemistry();this.doAddHydrogens&&this.jbr.finalizeHydrogens();null!=a&&(this.ms.calculatePolymers(this.groups,this.groupCount,this.baseGroupIndex,
null),null!=this.jbr&&this.jbr.iterateOverAllNewStructures(a,b));this.setDefaultRendering(this.vwr.getInt(553648170));var f=this.vwr.rd;d=this.ms.ac;for(var c=this.ms.at,e=this.baseAtomIndex;e<d;e++)c[e].setMadAtom(this.vwr,f);f=this.ms.am;for(e=f[this.baseModelIndex].firstAtomIndex;e<d;e++)null!=c[e]&&f[c[e].mi].bsAtoms.set(e);this.freeze();this.finalizeShapes();this.vwr.setModelSet(this.ms);this.setAtomProperties();null!=a&&a.finish(b);null!=this.modelSet0&&this.modelSet0.releaseModelSet();this.modelSet0=
null},"J.api.JmolAdapter,~O,JU.BS");c(c$,"mergeTrajAndVib",function(a,b){this.baseModelCount=a.mc;this.baseTrajectoryCount=0;null==a.trajectory&&this.isTrajectory&&this.newTrajectory(a,new JU.Lst);if(!(null==a.trajectory||0==a.mc)){this.baseTrajectoryCount=a.mc;for(var d=a.trajectory.steps.size(),c=d;c<this.baseTrajectoryCount;c++)a.trajectory.steps.addLast(null);if(this.isTrajectory){if(null==a.vibrationSteps){a.vibrationSteps=new JU.Lst;for(c=d;0<=--c;)a.vibrationSteps.addLast(null)}d=b.trajectory.steps.size();
for(c=0;c<d;c++)a.trajectory.steps.addLast(b.trajectory.steps.get(c)),a.vibrationSteps.addLast(null==b.vibrationSteps?null:b.vibrationSteps.get(c))}else b.trajectory=this.newTrajectory(b,null);b.vibrationSteps=a.vibrationSteps;b.trajectory.steps=a.trajectory.steps;a.trajectory=null}},"JM.ModelSet,JM.ModelSet");c(c$,"setDefaultRendering",function(a){if(!this.isPyMOLsession){for(var b=new JU.SB,d=this.ms.mc,c=this.ms.am,f=this.baseModelIndex;f<d;f++)c[f].isBioModel&&c[f].getDefaultLargePDBRendering(b,
a);0!=b.length()&&(b.append("select *;"),a=this.ms.getInfoM("jmolscript"),null==a&&(a=""),b.append(a),this.ms.msInfo.put("jmolscript",b.toString()))}},"~N");c(c$,"setAtomProperties",function(){for(var a=this.ms.mc,b=this.baseModelIndex;b<a;b++){var d=this.ms.getInfo(b,"atomProperties");null!=this.jmolData&&this.addJmolDataProperties(this.ms.am[b],this.ms.getInfo(b,"jmolDataProperties"));var c=this.ms.getInfo(b,"groupPropertyList");this.ms.am[b].isBioModel&&null!=this.ms.getInfo(b,"dssr")&&this.vwr.getAnnotationParser(!0).setGroup1(this.ms,
b);if(null!=d)for(var f,d=d.entrySet().iterator();d.hasNext()&&((f=d.next())||1);){var e=f.getKey(),h=f.getValue(),k=this.ms.getModelAtomBitSetIncludingDeleted(b,!0);if(this.doAddHydrogens)var j=null!=c&&JU.PT.isOneOf(e,c),h=this.jbr.fixPropertyValue(k,h,j);e="property_"+e.toLowerCase();JU.Logger.info("creating "+e+" for model "+this.ms.getModelName(b));this.vwr.setData(e,u(-1,[e,h,k,Integer.$valueOf(-1),Boolean.FALSE]),this.ms.ac,0,0,2147483647,0)}}});c(c$,"initializeAtomBondModelCounts",function(a){var b=
this.adapterTrajectoryCount;if(this.merging){if(this.appendNew)this.baseModelIndex=this.baseModelCount,this.ms.mc=this.baseModelCount+this.adapterModelCount;else{this.baseModelIndex=null==this.appendToModelIndex?this.vwr.am.cmi:this.appendToModelIndex.intValue();if(0>this.baseModelIndex||this.baseModelIndex>=this.baseModelCount)this.baseModelIndex=this.baseModelCount-1;this.ms.mc=this.baseModelCount}this.ms.ac=this.baseAtomIndex=this.modelSet0.ac;this.ms.bondCount=this.modelSet0.bondCount;this.$mergeGroups=
this.modelSet0.getGroups();this.groupCount=this.baseGroupIndex=this.$mergeGroups.length;this.ms.mergeModelArrays(this.modelSet0);this.ms.growAtomArrays(this.ms.ac+a)}else this.ms.mc=this.adapterModelCount,this.ms.ac=0,this.ms.bondCount=0,this.ms.at=Array(a),this.ms.bo=Array(250+a);this.doAddHydrogens&&this.jbr.initializeHydrogenAddition();1<b&&(this.ms.mc+=b-1);this.ms.am=JU.AU.arrayCopyObject(this.ms.am,this.ms.mc);this.ms.modelFileNumbers=JU.AU.arrayCopyI(this.ms.modelFileNumbers,this.ms.mc);this.ms.modelNumbers=
JU.AU.arrayCopyI(this.ms.modelNumbers,this.ms.mc);this.ms.modelNumbersForAtomLabel=JU.AU.arrayCopyS(this.ms.modelNumbersForAtomLabel,this.ms.mc);this.ms.modelNames=JU.AU.arrayCopyS(this.ms.modelNames,this.ms.mc);this.ms.frameTitles=JU.AU.arrayCopyS(this.ms.frameTitles,this.ms.mc);if(this.merging)for(a=0;a<this.modelSet0.mc;a++)(this.ms.am[a]=this.modelSet0.am[a]).ms=this.ms},"~N");c(c$,"mergeGroups",function(){var a=this.modelSet0.getAuxiliaryInfo(null),b=a.get("group3Lists"),a=a.get("group3Counts");
if(null!=b){for(var d=0;d<this.baseModelCount;d++)this.group3Lists[d+1]=b[d+1],this.group3Counts[d+1]=a[d+1],this.structuresDefinedInFile.set(d);this.group3Lists[0]=b[0];this.group3Counts[0]=a[0]}!this.appendNew&&this.ms.haveBioModels&&this.structuresDefinedInFile.clear(this.baseModelIndex)});c(c$,"iterateOverAllNewModels",function(a,b){this.group3Lists=Array(this.ms.mc+1);this.group3Counts=JU.AU.newInt2(this.ms.mc+1);this.structuresDefinedInFile=new JU.BS;this.merging&&this.mergeGroups();for(var d=
this.isTrajectory?this.baseTrajectoryCount:-1,c=this.baseModelIndex,f=0;f<this.adapterModelCount;++f,++c){var e=a.getAtomSetNumber(b,f),h=a.getAtomSetName(b,f),k=a.getAtomSetAuxiliaryInfo(b,f);k.containsKey("modelID")&&k.put("modelID0",k.get("modelID"));var j=k.get("modelProperties");this.vwr.setStringProperty("_fileType",k.get("fileType"));null==h&&(h=null!=this.jmolData&&2<this.jmolData.indexOf(";")?this.jmolData.substring(this.jmolData.indexOf(":")+2,this.jmolData.indexOf(";")):this.appendNew?
""+e%1E6:"");this.setModelNameNumberProperties(c,d,h,e,j,k,this.jmolData)}d=this.ms.am[null==this.appendToModelIndex?this.baseModelIndex:this.ms.mc-1];this.vwr.setSmilesString(this.ms.msInfo.get("smilesString"));f=this.ms.msInfo.remove("loadState");e=this.ms.msInfo.remove("loadScript");if(0>e.indexOf("Viewer.AddHydrogens")||!d.isModelKit){h=JU.PT.split(f,"\n");k=new JU.SB;for(f=0;f<h.length;f++)j=d.loadState.indexOf(h[f]),(0>j||j!=d.loadState.lastIndexOf(h[f]))&&k.append(h[f]).appendC("\n");d.loadState+=
d.loadScript.toString()+k.toString();d.loadScript=new JU.SB;if(0<=e.indexOf("load append ")||0<=e.indexOf('data "append '))e.insert(0,";var anew = appendNew;"),e.append(";set appendNew anew");d.loadScript.append("  ").appendSB(e).append(";\n")}if(this.isTrajectory){f=this.ms.mc-c+1;JU.Logger.info(f+" trajectory steps read");this.ms.setInfo(this.baseModelCount,"trajectoryStepCount",Integer.$valueOf(f));d=this.adapterModelCount;for(f=c;f<this.ms.mc;f++,d++)this.ms.am[f]=this.ms.am[this.baseModelCount],
this.ms.modelNumbers[f]=a.getAtomSetNumber(b,d),this.ms.modelNames[f]=a.getAtomSetName(b,d),this.structuresDefinedInFile.set(f)}this.finalizeModels(this.baseModelCount)},"J.api.JmolAdapter,~O");c(c$,"setModelNameNumberProperties",function(a,b,d,c,f,e,h){if(this.appendNew){var k=null!=e&&Boolean.TRUE===e.get("isPDB");this.ms.am[a]=k?this.jbr.getBioModel(a,b,h,f,e):(new JM.Model).set(this.ms,a,b,h,f,e);this.ms.modelNumbers[a]=c;this.ms.modelNames[a]=d;k&&this.jbr.setGroupLists(a)}else b=e.get("PDB_CONECT_firstAtom_count_max"),
null!=b&&this.ms.setInfo(a,"PDB_CONECT_firstAtom_count_max",b);b=this.ms.am;c=this.ms.at;b[a].bsAtoms.set(c.length+1);b[a].bsAtoms.clear(c.length+1);c=this.ms.getInfo(a,"altLocs");b[a].altLocCount=null==c?0:c.length;null!=c&&(c=c.toCharArray(),java.util.Arrays.sort(c),c=String.valueOf(c),this.ms.setInfo(a,"altLocs",c));c=this.ms.getInfo(a,"insertionCodes");b[a].insertionCount=null==c?0:c.length;d=null!=this.ms.modelSetName&&this.ms.modelSetName.startsWith("Jmol Model Kit")||d.startsWith("Jmol Model Kit")||
"Jme".equals(this.ms.getInfo(a,"fileType"));b[a].isModelKit=d},"~N,~N,~S,~N,java.util.Properties,java.util.Map,~S");c(c$,"finalizeModels",function(a){var b=this.ms.mc;if(b!=a){var d,c=0,f=-1,e=this.ms.modelNumbers,h=this.ms.modelNames;if(this.isTrajectory)for(var k=a;++k<this.ms.mc;)e[k]=e[k-1]+1;if(0<a){if(1E6>e[0])for(k=0;k<a;k++)0==h[k].length&&(h[k]=""+e[k]),e[k]+=1E6,this.ms.modelNumbersForAtomLabel[k]="1."+(k+1);var j=e[a-1],j=j-j%1E6;1E6>e[a]&&(j+=1E6);for(k=a;k<b;k++)e[k]+=j}for(var z=this.ms.am,
k=a;k<b;++k)if(this.ms.setInfo(k,"fileType",this.ms.modelSetTypeName),null!=this.fileHeader&&this.ms.setInfo(k,"fileHeader",this.fileHeader),j=w(e[k]/1E6),j!=f&&(c=0,f=j),c++,0==j?(d=""+this.ms.getModelNumber(k),j=1):d=j+"."+c,this.ms.modelNumbersForAtomLabel[k]=d,z[k].fileIndex=j-1,this.ms.modelFileNumbers[k]=1E6*j+c,null==h[k]||0==h[k].length)h[k]=d;if(this.merging)for(k=0;k<a;k++)z[k].ms=this.ms;for(k=0;k<b;k++)this.ms.setInfo(k,"modelName",h[k]),this.ms.setInfo(k,"modelNumber",Integer.$valueOf(e[k]%
1E6)),this.ms.setInfo(k,"modelFileNumber",Integer.$valueOf(this.ms.modelFileNumbers[k])),this.ms.setInfo(k,"modelNumberDotted",this.ms.getModelNumberDotted(k)),a=this.ms.getInfo(k,"altLocs"),null!=a&&JU.Logger.info("model "+this.ms.getModelNumberDotted(k)+" alternative locations: "+a)}},"~N");c(c$,"iterateOverAllNewAtoms",function(a,b){var d=-1,c=!1,f=!1,e=a.getAtomIterator(b);this.ms.setCapacity(a.getAtomCount(b));var h=0,k=this.ms.am;0<this.ms.mc&&(this.nullGroup=(new JM.Group).setGroup(new JM.Chain(this.ms.am[this.baseModelIndex],
32,0),"",0,-1,-1));for(;e.hasNext();){h++;var j=e.getAtomSetIndex()+this.baseModelIndex;j!=d&&(this.iChain=0,this.iModel=j,this.model=k[j],this.currentChainID=2147483647,this.isNewChain=!0,this.model.bsAtoms.clearAll(),this.model.isOrderly=null==this.appendToModelIndex,c=this.model.isBioModel,d=j,f=c&&this.doAddHydrogens,null!=this.jbr&&this.jbr.setHaveHsAlready(!1));var j=e.getGroup3(),z=e.getChainID();this.checkNewGroup(a,z,j,e.getSequenceNumber(),e.getInsertionCode(),f,!1);z=e.getElementNumber();
f&&1==JU.Elements.getElementNumber(z)&&this.jbr.setHaveHsAlready(!0);var m=e.getAtomName(),r=f?this.getPdbCharge(j,m):e.getFormalCharge();this.addAtom(c,e.getSymmetry(),e.getAtomSite(),e.getUniqueID(),z,m,r,e.getPartialCharge(),e.getTensors(),e.getOccupancy(),e.getBfactor(),e.getXYZ(),e.getIsHetero(),e.getSerial(),e.getSeqID(),j,e.getVib(),e.getAltLoc(),e.getRadius(),e.getBondRadius())}0<this.groupCount&&f&&this.jbr.addImplicitHydrogenAtoms(a,this.groupCount-1,this.isNewChain?1:0);d=-1;c=null;f=this.ms.at;
for(e=k[0].firstAtomIndex=0;e<this.ms.ac;e++)null!=f[e]&&f[e].mi>d&&(d=f[e].mi,j=k[d],j.firstAtomIndex=e,j.isOrderly=j.act==j.bsAtoms.length(),j=this.ms.getDefaultVdwType(d),j!==c&&(JU.Logger.info("Default Van der Waals type for model set to "+j.getVdwLabel()),c=j));JU.Logger.info(h+" atoms created")},"J.api.JmolAdapter,~O");c(c$,"addJmolDataProperties",function(a,b){if(null!=b)for(var d=a.bsAtoms,c=d.cardinality(),f,e=b.entrySet().iterator();e.hasNext()&&((f=e.next())||1);){var h=f.getKey(),k=f.getValue();
if(k.length!=c)break;var j=h.startsWith("property_")?1715472409:JS.T.getTokFromName(h);switch(j){default:if(JS.T.tokAttr(j,2048)){this.vwr.setAtomProperty(d,j,0,0,null,k,null);break}case 1111492629:case 1111492630:case 1111492631:h="property_"+h;case 1715472409:this.vwr.setData(h,u(-1,[h,k,d,Integer.$valueOf(1)]),0,0,0,0,0)}}},"JM.Model,java.util.Map");c(c$,"getPdbCharge",function(a,b){return a.equals("ARG")&&b.equals("NH1")||a.equals("LYS")&&b.equals("NZ")||a.equals("HIS")&&b.equals("ND1")?1:0},
"~S,~S");c(c$,"addAtom",function(a,b,d,c,f,e,h,k,j,z,m,r,n,p,q,s,u,t,v,w){var A=0,B=null;if(null!=e){var D;if(0<=(D=e.indexOf("\x00")))B=e.substring(D+1),e=e.substring(0,D);a&&(0<=e.indexOf("*")&&(e=e.$replace("*","'")),A=this.vwr.getJBR().lookupSpecialAtomID(e),2==A&&"CA".equalsIgnoreCase(s)&&(A=0))}a=this.ms.addAtom(this.iModel,this.nullGroup,f,e,B,p,q,d,r,v,u,h,k,z,m,j,n,A,b,w);a.altloc=t;this.htAtomMap.put(c,a)},"~B,JU.BS,~N,~O,~N,~S,~N,~N,JU.Lst,~N,~N,JU.P3,~B,~N,~N,~S,JU.V3,~S,~N,~N");c(c$,
"checkNewGroup",function(a,b,d,c,f,e,h){var k=null==d?null:d.intern();b!=this.currentChainID&&(this.currentChainID=b,this.currentChain=this.getOrAllocateChain(this.model,b),this.currentGroupInsertionCode="\uffff",this.currentGroupSequenceNumber=-1,this.currentGroup3="xxxx",this.isNewChain=!0);if(c!=this.currentGroupSequenceNumber||f!=this.currentGroupInsertionCode||k!==this.currentGroup3){0<this.groupCount&&e&&(this.jbr.addImplicitHydrogenAtoms(a,this.groupCount-1,this.isNewChain&&!h?1:0),this.jbr.setHaveHsAlready(!1));
this.currentGroupSequenceNumber=c;this.currentGroupInsertionCode=f;for(this.currentGroup3=k;this.groupCount>=this.group3Of.length;)this.chainOf=JU.AU.doubleLength(this.chainOf),this.group3Of=JU.AU.doubleLengthS(this.group3Of),this.seqcodes=JU.AU.doubleLengthI(this.seqcodes),this.firstAtomIndexes=JU.AU.doubleLengthI(this.firstAtomIndexes);this.firstAtomIndexes[this.groupCount]=this.ms.ac;this.chainOf[this.groupCount]=this.currentChain;this.group3Of[this.groupCount]=d;this.seqcodes[this.groupCount]=
JM.Group.getSeqcodeFor(c,f);++this.groupCount}},"J.api.JmolAdapter,~N,~S,~N,~S,~B,~B");c(c$,"getOrAllocateChain",function(a,b){var d=a.getChain(b);if(null!=d)return d;a.chainCount==a.chains.length&&(a.chains=JU.AU.doubleLength(a.chains));return a.chains[a.chainCount++]=new JM.Chain(a,b,0==b||32==b?0:++this.iChain)},"JM.Model,~N");c(c$,"iterateOverAllNewBonds",function(a,b){var d=a.getBondIterator(b);if(null!=d){var c=this.vwr.getMadBond(),f=this.isMutate&&!this.vwr.getBoolean(603979894);this.ms.defaultCovalentMad=
null==this.jmolData?c:0;for(var e=!1;d.hasNext();){var h=d.getEncodedOrder(),k=f?1:h,j=this.bondAtoms(d.getAtomUniqueID1(),d.getAtomUniqueID2(),k);null!=j&&(1<k&&(1025!=k&&1041!=k)&&(e=!0),k=d.getRadius(),0<k&&j.setMad($(2E3*k)),k=d.getColix(),0<=k&&(j.colix=k),j.order|=h&98304)}e&&(this.ms.someModelsHaveSymmetry&&!this.vwr.getBoolean(603979794))&&JU.Logger.info('ModelSet: use "set appletSymmetryToBonds TRUE " to apply the file-based multiple bonds to symmetry-generated atoms.');this.ms.defaultCovalentMad=
c}},"J.api.JmolAdapter,~O");c(c$,"bondAtoms",function(a,b,d){var c=this.htAtomMap.get(a);if(null==c)return JU.Logger.error("bondAtoms cannot find atomUid1?:"+a),null;a=this.htAtomMap.get(b);if(null==a)return JU.Logger.error("bondAtoms cannot find atomUid2?:"+b),null;if(c.isBonded(a))return null;1025==d||1041==d?(b=c.getModelIndex(),b!=this.lastModel&&(this.lastModel=b,b=this.ms.getModelAuxiliaryInfo(b),this.isMOL2D=null!=b&&"2D".equals(b.get("dimension"))),d=this.ms.bondMutually(c,a,this.isMOL2D?
d:1,this.ms.getDefaultMadFromOrder(1),0),null==this.vStereo&&(this.vStereo=new JU.Lst),this.vStereo.addLast(d)):(d=this.ms.bondMutually(c,a,d,this.ms.getDefaultMadFromOrder(d),0),d.isAromatic()&&(this.ms.someModelsHaveAromaticBonds=!0));this.ms.bondCount==this.ms.bo.length&&(this.ms.bo=JU.AU.arrayCopyObject(this.ms.bo,this.ms.bondCount+250));this.ms.setBond(this.ms.bondCount++,d);return d},"~O,~O,~N");c(c$,"initializeUnitCellAndSymmetry",function(){this.someModelsAreModulated&&null==this.ms.bsModulated&&
(this.ms.bsModulated=new JU.BS);if(this.someModelsHaveUnitcells){this.ms.unitCells=Array(this.ms.mc);this.ms.haveUnitCells=!0;for(var a=null!=this.modelSet0&&null!=this.modelSet0.unitCells,b=0,d=0;b<this.ms.mc;b++)if(a&&b<this.baseModelCount)this.ms.unitCells[b]=this.modelSet0.unitCells[b];else{this.ms.unitCells[b]=J.api.Interface.getSymmetry(this.vwr,"file");var c=null;if(this.isTrajectory){var f=this.ms.getInfoM("unitCells");null!=f&&(c=f.get(d++))}this.ms.unitCells[b].setSymmetryInfo(b,this.ms.getModelAuxiliaryInfo(b),
c)}}if(this.appendNew&&this.ms.someModelsHaveSymmetry){this.ms.getAtoms(1088421903,null);a=this.ms.at;b=this.baseAtomIndex;d=-1;for(c=0;b<this.ms.ac;b++)a[b].mi!=d&&(d=a[b].mi,c=this.baseAtomIndex+this.ms.getInfoI(d,"presymmetryAtomIndex")+this.ms.getInfoI(d,"presymmetryAtomCount")),b>=c&&this.ms.bsSymmetry.set(b)}if(this.appendNew&&this.ms.someModelsHaveFractionalCoordinates){for(var a=this.ms.at,d=-1,c=null,f=!1,e=!this.vwr.g.legacyJavaFloat,b=this.baseAtomIndex;b<this.ms.ac;b++)a[b].mi!=d&&(d=
a[b].mi,c=this.ms.getUnitCell(d),f=null!=c&&c.getCoordinatesAreFractional()),f&&(c=a[b].getUnitCell(),c.toCartesian(c.toSupercell(a[b]),!1),e&&JU.PT.fixPtFloats(a[b],1E4));for(b=this.baseModelIndex;b<this.ms.mc;b++)this.ms.isTrajectory(b)&&this.ms.trajectory.setUnitCell(b)}});c(c$,"initializeBonding",function(){var a=this.ms.mc,b=this.ms.am,d=0,c=this.ms.getInfoM("bsExcludeBonding");null==c&&(c=null==this.ms.getInfoM("someModelsHaveCONECT")?null:new JU.BS,null!=c&&this.ms.setPdbConectBonding(this.baseAtomIndex,
this.baseModelIndex,c));var f=this.vwr.getBoolean(603979794),e=this.vwr.getBoolean(603979798),h=this.vwr.getBoolean(603979846),k=null,j=!1;if(!this.noAutoBond)for(var z=this.baseModelIndex;z<a;z++){var d=b[z].bsAtoms.cardinality(),m=this.ms.getInfoI(z,"initialBondCount"),r=b[z].isBioModel;0>m&&(m=this.ms.bondCount);if(h||e&&(0==m||r&&null==this.jmolData&&(this.ms.getMSInfoB("havePDBHeaderName")||m<w(d/2))||this.ms.getInfoB(z,"hasSymmetry")&&!f&&!this.ms.getInfoB(z,"hasBonds")))if(j=!0,this.merging||
1<a)null==k&&(k=JU.BS.newN(this.ms.ac)),(z==this.baseModelIndex||!this.isTrajectory)&&k.or(b[z].bsAtoms)}this.modulationOn&&this.ms.setModulation(null,!0,this.modulationTUV,!1);j?(this.ms.autoBondBs4(k,k,c,null,this.ms.defaultCovalentMad,this.vwr.getBoolean(603979872)),JU.Logger.info("ModelSet: autobonding; use  autobond=false  to not generate bonds automatically")):JU.Logger.info("ModelSet: not autobonding; use  forceAutobond=true  to force automatic bond creation")});c(c$,"finalizeGroupBuild",function(){this.groups=
Array(this.groupCount);if(this.merging)for(var a=0;a<this.$mergeGroups.length;a++)(this.groups[a]=this.$mergeGroups[a]).chain.model.ms=this.ms;for(a=this.baseGroupIndex;a<this.groupCount;++a)this.distinguishAndPropagateGroup(a,this.chainOf[a],this.group3Of[a],this.seqcodes[a],this.firstAtomIndexes[a],(a==this.groupCount-1?this.ms.ac:this.firstAtomIndexes[a+1])-1);if(null!=this.group3Lists){this.ms.msInfo.put("group3Lists",this.group3Lists);this.ms.msInfo.put("group3Counts",this.group3Counts);for(a=
0;a<this.group3Counts.length;a++)null==this.group3Counts[a]&&(this.group3Counts[a]=B(0,0))}});c(c$,"distinguishAndPropagateGroup",function(a,b,d,c,f,e){if(e<f)throw new NullPointerException;var h=null==d||null==this.jbr?null:this.jbr.distinguishAndPropagateGroup(b,d,c,f,e,this.specialAtomIndexes,this.ms.at);null==h?(h=(new JM.Group).setGroup(b,d,c,f,e),null!=this.jbr&&(h.groupID=this.jbr.getGroupID(d)),c="o>"):c=h.isProtein()?"p>":h.isNucleic()?"n>":h.isCarbohydrate()?"c>":"o>";null!=d&&(this.countGroup(this.ms.at[f].mi,
c,d),h.isNucleic()&&(d=null==this.htGroup1?null:this.htGroup1.get(d),null!=d&&(h.group1=d.charAt(0))));this.addGroup(b,h);this.groups[a]=h;h.groupIndex=a;for(a=e+1;--a>=f;)this.ms.at[a].group=h},"~N,JM.Chain,~S,~N,~N,~N");c(c$,"addGroup",function(a,b){a.groupCount==a.groups.length&&(a.groups=JU.AU.doubleLength(a.groups));a.groups[a.groupCount++]=b},"JM.Chain,JM.Group");c(c$,"countGroup",function(a,b,d){var c=a+1;if(!(null==this.group3Lists||null==this.group3Lists[c])){var f=(d+"   ").substring(0,
3),e=this.group3Lists[c].indexOf(f);0>e&&(this.group3Lists[c]+=",["+f+"]",e=this.group3Lists[c].indexOf(f),this.group3Counts[c]=JU.AU.arrayCopyI(this.group3Counts[c],this.group3Counts[c].length+10));this.group3Counts[c][w(e/6)]++;e=this.group3Lists[c].indexOf(",["+f);0<=e&&(this.group3Lists[c]=this.group3Lists[c].substring(0,e)+b+this.group3Lists[c].substring(e+2));0<=a&&this.countGroup(-1,b,d)}},"~N,~S,~S");c(c$,"freeze",function(){this.htAtomMap.clear();this.ms.ac<this.ms.at.length&&this.ms.growAtomArrays(this.ms.ac);
this.ms.bondCount<this.ms.bo.length&&(this.ms.bo=JU.AU.arrayCopyObject(this.ms.bo,this.ms.bondCount));for(var a=5;0<--a;){this.ms.numCached[a]=0;for(var b=this.ms.freeBonds[a],d=b.length;0<=--d;)b[d]=null}this.ms.setAtomNamesAndNumbers(0,this.baseAtomIndex,this.modelSet0);this.findElementsPresent();this.ms.resetMolecules();this.currentChain=this.model=null;!this.ms.haveBioModels||this.isPyMOLsession||this.isMutate?this.ms.freezeModels():(a=this.vwr.getBoolean(603979826),a=this.ms.calculateStructuresAllExcept(this.structuresDefinedInFile,
a,!1,!0,!0,a,1405E3<=JV.JC.versionInt&&null==this.ms.getInfoM("DSSP1")?2:1),0<a.length&&JU.Logger.info(a))});c(c$,"findElementsPresent",function(){this.ms.elementsPresent=Array(this.ms.mc);for(var a=0;a<this.ms.mc;a++)this.ms.elementsPresent[a]=JU.BS.newN(64);for(a=this.ms.ac;0<=--a;){var b=this.ms.at[a];if(null!=b){var d=b.getAtomicAndIsotopeNumber();d>=JU.Elements.elementNumberMax&&(d=JU.Elements.elementNumberMax+JU.Elements.altElementIndexFromNumber(d));this.ms.elementsPresent[b.mi].set(d)}}});
c(c$,"applyStereochemistry",function(){this.set2DLengths(this.baseAtomIndex,this.ms.ac);var a=new JU.V3;if(null!=this.vStereo){var b=this.vStereo.size();a:for(;0<=--b;)for(var d=this.vStereo.get(b),c=d.atom1,f=c.bonds,e=c.getBondCount();0<=--e;){var h=f[e];if(h!==d&&(h=h.getOtherAtom(c),a.sub2(h,c),0.1>Math.abs(a.x))){1025==d.order==0>a.y&&(this.stereodir=-1);break a}}}this.set2dZ(this.baseAtomIndex,this.ms.ac,a);if(null!=this.vStereo){a=new JU.BS;a.setBits(this.baseAtomIndex,this.ms.ac);for(b=this.vStereo.size();0<=
--b;){d=this.vStereo.get(b);c=1025==d.order?3:-3;d.order=1;d.atom2.z!=d.atom1.z&&0>c==d.atom2.z<d.atom1.z&&(c/=3);f=JU.JmolMolecule.getBranchBitSet(this.ms.at,d.atom2.i,a,null,d.atom1.i,!1,!0);f.set(d.atom2.i);for(e=f.nextSetBit(0);0<=e;e=f.nextSetBit(e+1))this.ms.at[e].z+=c;d.atom2.x=(d.atom1.x+d.atom2.x)/2;d.atom2.y=(d.atom1.y+d.atom2.y)/2}this.vStereo=null}this.is2D=!1});c(c$,"set2DLengths",function(a,b){for(var d=0,c=0,f=a;f<b;f++){var e=this.ms.at[f],h=e.bonds;if(null!=h)for(var k=h.length;0<=
--k;)if(null!=h[k]){var j=h[k].getOtherAtom(e);1!=j.getAtomNumber()&&j.getIndex()>f&&(d+=j.distance(e),c++)}}if(0!=c){d=1.45/(d/c);for(f=a;f<b;f++)this.ms.at[f].scale(d)}},"~N,~N");c(c$,"set2dZ",function(a,b,d){var c=JU.BS.newN(b),f=new JU.BS,e=JU.V3.new3(0,1,0),h=new JU.V3,k=new JU.BS;for(k.setBits(a,b);a<b;a++)!c.get(a)&&!f.get(a)&&(f=this.getBranch2dZ(a,-1,k,f,d,e,h,this.stereodir),c.or(f))},"~N,~N,JU.V3");c(c$,"getBranch2dZ",function(a,b,d,c,f,e,h,k){c=JU.BS.newN(this.ms.ac);if(0>a)return c;var j=
new JU.BS;j.or(d);0<=b&&j.clear(b);JM.ModelLoader.setBranch2dZ(this.ms.at[a],c,j,f,e,h,k);return c},"~N,~N,JU.BS,JU.BS,JU.V3,JU.V3,JU.V3,~N");c$.setBranch2dZ=c(c$,"setBranch2dZ",function(a,b,d,c,f,e,h){var k=a.i;if(d.get(k)&&(d.clear(k),b.set(k),null!=a.bonds))for(k=a.bonds.length;0<=--k;){var j=a.bonds[k];j.isHydrogen()||(j=j.getOtherAtom(a),JM.ModelLoader.setAtom2dZ(a,j,c,f,e,h),JM.ModelLoader.setBranch2dZ(j,b,d,c,f,e,h))}},"JM.Atom,JU.BS,JU.BS,JU.V3,JU.V3,JU.V3,~N");c$.setAtom2dZ=c(c$,"setAtom2dZ",
function(a,b,d,c,f,e){d.sub2(b,a);d.z=0;d.normalize();f.cross(c,d);d=Math.acos(d.dot(c));e=0.4*-e*Math.sin(4*d);b.z=a.z+e},"JM.Atom,JM.Atom,JU.V3,JU.V3,JU.V3,~N");c(c$,"finalizeShapes",function(){this.ms.sm=this.vwr.shm;this.ms.sm.setModelSet(this.ms);this.ms.setBsHidden(this.vwr.slm.getHiddenSet());this.merging||this.ms.sm.resetShapes();this.ms.sm.loadDefaultShapes(this.ms);this.ms.someModelsHaveAromaticBonds&&this.vwr.getBoolean(603979944)&&this.ms.assignAromaticBondsBs(!1,null);this.merging&&1==
this.baseModelCount&&this.ms.sm.setShapePropertyBs(6,"clearModelIndex",null,null)});c(c$,"undeleteAtom",function(a){this.ms.at[a].valence=0},"~N");c$.createAtomDataSet=c(c$,"createAtomDataSet",function(a,b,d,c,f){if(null==c)return null;var e=a.getModelAdapter(),h=new JU.P3,k=b.at,j=a.getFloat(570425363);if(null!=b.unitCells)for(var z=f.nextSetBit(0);0<=z;z=f.nextSetBit(z+1))if(null!=k[z].atomSymmetry){j=-j;break}for(var z=-1,m=0,r=JU.BSUtil.cardinalityOf(f)==a.ms.ac,n=e.getAtomIterator(c);n.hasNext();){var p=
n.getXYZ();if(!Float.isNaN(p.x+p.y+p.z))if(1145047050==d){z=f.nextSetBit(z+1);if(0>z)break;m++;JU.Logger.debugging&&JU.Logger.debug("atomIndex = "+z+": "+k[z]+" --\x3e ("+p.x+","+p.y+","+p.z);b.setAtomCoord(z,p.x,p.y,p.z)}else{h.setT(p);p=JU.BS.newN(b.ac);b.getAtomsWithin(j,h,p,-1);p.and(f);if(r)if(m=JU.BSUtil.cardinalityOf(p),0==m){JU.Logger.warn("createAtomDataSet: no atom found at position "+h);continue}else 1<m&&JU.Logger.debugging&&JU.Logger.debug("createAtomDataSet: "+m+" atoms found at position "+
h);switch(d){case 1145047055:var q=n.getVib();if(null==q)continue;JU.Logger.debugging&&JU.Logger.debug("xyz: "+h+" vib: "+q);b.setAtomCoords(p,1145047055,q);break;case 1128269825:b.setAtomProperty(p,d,0,n.getOccupancy(),null,null,null);break;case 1111492619:b.setAtomProperty(p,d,0,n.getPartialCharge(),null,null,null);break;case 1111492620:b.setAtomProperty(p,d,0,n.getBfactor(),null,null,null)}}}switch(d){case 1145047055:b=e.getAtomSetName(c,0);JU.Logger.info("_vibrationName = "+b);a.setStringProperty("_vibrationName",
b);break;case 1145047050:if(JU.Logger.info(m+" atom positions read"),b.recalculateLeadMidpointsAndWingVectors(-1),m==b.ac)return"boundbox {*};reset"}return null},"JV.Viewer,JM.ModelSet,~N,~O,JU.BS");E(c$,"defaultGroupCount",32)});s("JM");v(["JM.BondCollection"],"JM.ModelSet","java.lang.Boolean $.Float java.util.Hashtable JU.A4 $.AU $.BS $.Lst $.M3 $.M4 $.Measure $.P3 $.P4 $.PT $.Quat $.SB $.V3 J.api.Interface $.JmolModulationSet J.atomdata.RadiusData J.bspt.Bspf J.c.PAL $.VDW JM.Atom $.AtomIteratorWithinModel $.AtomIteratorWithinModelSet $.HBond $.Model $.StateScript JS.ScriptCompiler JU.BSUtil $.BoxInfo $.Edge $.Elements $.Escape $.JmolMolecule $.Logger $.SimpleUnitCell JV.JC".split(" "),
function(){c$=t(function(){this.haveBioModels=!1;this.am=this.modelSetName=this.bsSymmetry=null;this.mc=0;this.unitCells=null;this.haveUnitCells=!1;this.elementsPresent=this.frameTitles=this.modelNames=this.modelNumbersForAtomLabel=this.modelFileNumbers=this.modelNumbers=this.closest=null;this.isXYZ=!1;this.msInfo=this.modelSetProperties=null;this.isBbcageDefault=this.someModelsHaveFractionalCoordinates=this.someModelsHaveAromaticBonds=this.someModelsHaveSymmetry=!1;this.stateScripts=this.boxInfo=
this.bboxAtoms=this.bboxModels=null;this.thisStateModel=0;this.selectedMolecules=this.vibrationSteps=null;this.showRebondTimes=!0;this.sm=this.bsAll=null;this.proteinStructureTainted=!1;this.vTemp=this.mat4t=this.mat4=this.matInv=this.matTemp=this.ptTemp2=this.ptTemp1=this.ptTemp=this.vOrientations=this.htPeaks=null;this.echoShapeActive=!1;this.defaultBBox=this.translations=this.modelSetTypeName=null;this.maxBondWarned=!1;p(this,arguments)},JM,"ModelSet",JM.BondCollection);c(c$,"getBoxInfo",function(){return this.boxInfo});
q(c$,function(a,b){I(this,JM.ModelSet,[]);this.vwr=a;this.modelSetName=b;this.selectedMolecules=new JU.BS;this.stateScripts=new JU.Lst;this.boxInfo=new JU.BoxInfo;this.boxInfo.addBoundBoxPoint(JU.P3.new3(-10,-10,-10));this.boxInfo.addBoundBoxPoint(JU.P3.new3(10,10,10));this.am=Array(1);this.modelNumbers=B(1,0);this.modelFileNumbers=B(1,0);this.modelNumbersForAtomLabel=Array(1);this.modelNames=Array(1);this.frameTitles=Array(1);this.closest=Array(1);this.ptTemp=new JU.P3;this.ptTemp1=new JU.P3;this.ptTemp2=
new JU.P3;this.matTemp=new JU.M3;this.matInv=new JU.M3;this.mat4=new JU.M4;this.mat4t=new JU.M4;this.vTemp=new JU.V3;this.setupBC()},"JV.Viewer,~S");c(c$,"releaseModelSet",function(){this.am=null;this.unitCells=this.bsAll=this.bsSymmetry=this.am=this.closest[0]=null;this.releaseModelSetBC()});c(c$,"getEchoStateActive",function(){return this.echoShapeActive});c(c$,"setEchoStateActive",function(a){this.echoShapeActive=a},"~B");c(c$,"getModelSetTypeName",function(){return this.modelSetTypeName});c(c$,
"getModelNumberIndex",function(a,b,d){if(b){for(b=0;b<this.mc;b++)if(this.modelNumbers[b]==a||1E6>a&&this.modelNumbers[b]==1E6+a)return b;return-1}if(1E6>a)return a;for(b=0;b<this.mc;b++)if(this.modelFileNumbers[b]==a)return d&&this.isTrajectory(b)&&this.setTrajectory(b),b;return-1},"~N,~B,~B");c(c$,"getModelDataBaseName",function(a){for(var b=0;b<this.mc;b++)if(a.equals(this.am[b].bsAtoms))return this.getInfo(b,"dbName");return null},"JU.BS");c(c$,"setTrajectory",function(a){0<=a&&(this.isTrajectory(a)&&
this.at[this.am[a].firstAtomIndex].mi!=a)&&this.trajectory.setModel(a)},"~N");c(c$,"getBitSetTrajectories",function(){return null==this.trajectory?null:this.trajectory.getModelsSelected()});c(c$,"setTrajectoryBs",function(a){if(null!=this.trajectory)for(var b=0;b<this.mc;b++)a.get(b)&&this.setTrajectory(b)},"JU.BS");c(c$,"morphTrajectories",function(a,b,d){0<=a&&(0<=b&&this.isTrajectory(a)&&this.isTrajectory(b))&&this.trajectory.morph(a,b,d)},"~N,~N,~N");c(c$,"getTranslation",function(a){return null==
this.translations||a>=this.translations.length?null:this.translations[a]},"~N");c(c$,"translateModel",function(a,b){if(null==b){var d=this.getTranslation(a);null!=d&&(b=JU.P3.newP(d),b.scale(-1),this.translateModel(a,b),this.translations[a]=null)}else{if(null==this.translations||this.translations.length<=a)this.translations=Array(this.mc);null==this.translations[a]&&(this.translations[a]=new JU.P3);this.translations[a].add(b);for(var d=this.am[a].bsAtoms,c=d.nextSetBit(0);0<=c;c=d.nextSetBit(c+1))this.at[c].add(b)}},
"~N,JU.T3");c(c$,"getFrameOffsets",function(a,b){if(null==a){if(b)for(var d=this.mc;0<=--d;){var c=this.am[d];!c.isJmolDataFrame&&!c.isTrajectory&&this.translateModel(c.modelIndex,null)}return null}if(0>a.nextSetBit(0))return null;if(b){for(var f=JU.BSUtil.copy(a),e=null,h=new JU.P3,d=0;d<this.mc;d++){c=this.am[d];if(!c.isJmolDataFrame&&!c.isTrajectory){var k=f.nextSetBit(0);c.bsAtoms.get(k)&&(null==e?e=JU.P3.newP(this.at[k]):(h.sub2(e,this.at[k]),this.translateModel(d,h)))}f.andNot(c.bsAtoms)}return null}f=
Array(this.mc);for(d=this.mc;0<=--d;)f[d]=new JU.P3;var h=e=0,k=f[0],j=null!=this.trajectory&&this.trajectory.steps.size()==this.mc,z=j?this.mc:1;f[0].set(0,0,0);for(c=0;c<z;c++){j&&this.setTrajectory(c);for(d=0;d<=this.ac;d++){if(d==this.ac||this.at[d].mi!=e){0<h&&(k.scale(-1/h),0!=e&&k.sub(f[0]),h=0);if(d==this.ac)break;e=this.at[d].mi;k=f[e]}a.get(d)&&(k.add(this.at[d]),h++)}}return f},"JU.BS,~B");c(c$,"getAtoms",function(a,b){switch(a){default:return JU.BSUtil.andNot(this.getAtomBitsMaybeDeleted(a,
b),this.vwr.slm.bsDeleted);case 1073742358:var d=b.intValue(),c=this.getModelNumberIndex(d,!0,!0);return 0>c&&0<d?new JU.BS:this.vwr.getModelUndeletedAtomsBitSet(c);case 1275203608:return d=u(-1,[null,null,null]),this.vwr.shm.getShapePropertyData(21,"getCenters",d),null==d[1]?new JU.BS:d[1]}},"~N,~O");c(c$,"findNearestAtomIndex",function(a,b,d,c){if(0==this.ac)return-1;this.closest[0]=null;this.g3d.isAntialiased()&&(a<<=1,b<<=1);this.findNearest2(a,b,this.closest,d,c);this.sm.findNearestShapeAtomIndex(a,
b,this.closest,d);a=null==this.closest[0]?-1:this.closest[0].i;this.closest[0]=null;return a},"~N,~N,JU.BS,~N");c(c$,"calculatePointGroup",function(a){return this.calculatePointGroupForFirstModel(a,!1,!1,null,0,0,null,null,null)},"JU.BS");c(c$,"getPointGroupInfo",function(a){return this.calculatePointGroupForFirstModel(a,!1,!0,null,0,0,null,null,null)},"JU.BS");c(c$,"getPointGroupAsString",function(a,b,d,c,f,e,h){return this.calculatePointGroupForFirstModel(a,!0,!1,b,d,c,f,e,h)},"JU.BS,~S,~N,~N,~A,JU.P3,~S");
c(c$,"calculatePointGroupForFirstModel",function(a,b,d,c,f,e,h,k,j){var z=this.pointGroup,m=J.api.Interface.getSymmetry(this.vwr,"ms"),r=null,p=!1,n=!1,q=!1,s=null!=h,t=this.vwr.am.cmi;if(!s)if(h=null==a?-1:a.nextSetBit(0),0>t&&0<=h&&(t=this.at[h].mi),0>t&&(t=this.vwr.getVisibleFramesBitSet().nextSetBit(0),a=null),r=this.vwr.getModelUndeletedAtomsBitSet(t),q=null!=a&&r.cardinality()!=a.cardinality(),null!=a&&r.and(a),h=r.nextSetBit(0),0>h&&(r=this.vwr.getModelUndeletedAtomsBitSet(t),h=r.nextSetBit(0)),
n=this.vwr.shm.getShapePropertyIndex(18,"mad",h),p=null!=n&&0!=n.intValue()||this.vwr.tm.vibrationOn,n=null!=c&&0<=c.toUpperCase().indexOf(":POLY")){z=u(-1,[Integer.$valueOf(h),null]);this.vwr.shm.getShapePropertyData(21,"points",z);h=z[1];if(null==h)return null;r=null;p=!1;z=null}else h=this.at;var v;if(null!=c&&0<=(v=c.indexOf(":")))c=c.substring(0,v);if(null!=c&&0<=(v=c.indexOf(".")))f=JU.PT.parseInt(c.substring(v+1)),0>f&&(f=0),c=c.substring(0,v);z=m.setPointGroup(z,k,h,r,p,s?0:this.vwr.getFloat(570425382),
this.vwr.getFloat(570425384),q);!n&&!s&&(this.pointGroup=z);if(!b&&!d)return z.getPointGroupName();b=z.getPointGroupInfo(t,j,d,c,f,e);return d?b:(1<this.mc?"frame "+this.getModelNumberDotted(t)+"; ":"")+b},"JU.BS,~B,~B,~S,~N,~N,~A,JU.P3,~S");c(c$,"getDefaultStructure",function(a,b){return this.haveBioModels?this.bioModelset.getAllDefaultStructures(a,b):""},"JU.BS,JU.BS");c(c$,"deleteModelBonds",function(a){a=this.getModelAtomBitSetIncludingDeleted(a,!1);this.makeConnections(0,3.4028235E38,131071,
12291,a,a,null,!1,!1,0)},"~N");c(c$,"makeConnections",function(a,b,d,c,f,e,h,k,j,z){if(1073741852==c&&2048!=d){var m="connect ";0.1!=a&&(m+=a+" ");1E8!=b&&(m+=b+" ");this.addStateScript(m,k?f:null,k?null:f,k?null:e," auto",!1,!0)}this.moleculeCount=0;return this.makeConnections2(a,b,d,c,f,e,h,k,j,z)},"~N,~N,~N,~N,JU.BS,JU.BS,JU.BS,~B,~B,~N");c(c$,"setPdbConectBonding",function(a,b,d){for(var c=this.vwr.getMadBond();b<this.mc;b++){var f=this.getInfo(b,"PDB_CONECT_bonds");if(null!=f){var e=f.size();
this.setInfo(b,"initialBondCount",Integer.$valueOf(e));for(var h=this.getInfo(b,"PDB_CONECT_firstAtom_count_max"),k=h[0]+a,j=k+h[1],h=h[2],z=B(h+1,0),m=k;m<j;m++)if(0<(k=this.atomSerials[m]))z[k]=m+1;for(j=0;j<e;j++){var k=f.get(j),m=k[0],r=k[1],k=k[2];if(!(0>m||0>r||m>h||r>h))if(m=z[m]-1,r=z[r]-1,!(0>m||0>r)){var p=this.at[m],n=this.at[r];null!=d&&(p.isHetero()&&d.set(m),n.isHetero()&&d.set(r));if(p.altloc==n.altloc||"\x00"==p.altloc||"\x00"==n.altloc)this.getOrAddBond(p,n,k,2048==k?1:c,null,0,!1)}}}}},
"~N,~N,JU.BS");c(c$,"deleteAllBonds",function(){this.moleculeCount=0;for(var a=this.stateScripts.size();0<=--a;)this.stateScripts.get(a).isConnect()&&this.stateScripts.removeItemAt(a);this.deleteAllBonds2()});c(c$,"includeAllRelatedFrames",function(a){for(var b=0,d=0;d<this.mc;d++){var c=this.isTrajectory(d),f=c&&a.get(b=this.am[d].trajectoryBaseIndex);if(a.get(d)){if(c&&!f){a.set(b);this.includeAllRelatedFrames(a);break}}else(c||this.isJmolDataFrameForModel(d)&&a.get(this.am[d].dataSourceFrame))&&
a.set(d)}},"JU.BS");c(c$,"deleteModels",function(a){this.includeAllRelatedFrames(a);var b=a.cardinality();if(0==b)return null;this.moleculeCount=0;null!=this.msInfo&&this.msInfo.remove("models");for(var d=a.nextSetBit(0);0<=d;d=a.nextSetBit(d+1))this.clearDataFrameReference(d);var c;if(b==this.mc)return c=this.getModelAtomBitSetIncludingDeleted(-1,!0),this.vwr.zap(!0,!1,!1),c;this.validateBspf(!1);c=new JU.BS;for(var f=!0,e=!1,h=new JU.BS,d=0;d<this.mc;d++){var k=this.am[d],f=(new Boolean(f&k.isOrderly)).valueOf();
a.get(d)?(0<=k.fileIndex&&h.set(k.fileIndex),c.or(this.getModelAtomBitSetIncludingDeleted(d,!1))):0<=k.fileIndex&&h.get(k.fileIndex)&&(e=!0)}if(!f||e)return this.vwr.deleteAtoms(c,!1),null;b=Array(this.mc-b);f=this.am;for(e=d=0;d<this.mc;d++)a.get(d)||(k=this.am[d],k.modelIndex=e,b[e++]=k);this.am=b;k=this.mc;h=this.getBondsForSelectedAtoms(c,!0);this.deleteBonds(h,!0);for(e=d=0;d<k;d++)if(a.get(d)){var j=f[d],z=j.act;if(0!=z){var m=j.bsAtoms,j=j.firstAtomIndex;JU.BSUtil.deleteBits(this.bsSymmetry,
m);this.deleteModel(e,m,h);this.deleteModelAtoms(j,z,m);this.vwr.deleteModelAtoms(e,j,z,m);for(var r=k;--r>d;)f[r].fixIndices(e,z,m);this.vwr.shm.deleteShapeAtoms(u(-1,[b,this.at,B(-1,[e,j,z])]),m);this.mc--}}else e++;this.haveBioModels=!1;for(d=this.mc;0<=--d;)this.am[d].isBioModel&&(this.haveBioModels=!0,this.bioModelset.set(this.vwr,this));this.validateBspf(!1);this.bsAll=null;this.resetMolecules();this.isBbcageDefault=!1;this.calcBoundBoxDimensions(null,1);return c},"JU.BS");c(c$,"resetMolecules",
function(){this.molecules=this.bsAll=null;this.moleculeCount=0;this.resetChirality()});c(c$,"resetChirality",function(){if(this.haveChirality)for(var a=-1,b=this.ac;0<=--b;){var d=this.at[b];null!=d&&(d.setCIPChirality(0),d.mi!=a&&d.mi<this.am.length&&(this.am[a=d.mi].hasChirality=!1))}});c(c$,"deleteModel",function(a,b,d){if(!(0>a)){this.modelNumbers=JU.AU.deleteElements(this.modelNumbers,a,1);this.modelFileNumbers=JU.AU.deleteElements(this.modelFileNumbers,a,1);this.modelNumbersForAtomLabel=JU.AU.deleteElements(this.modelNumbersForAtomLabel,
a,1);this.modelNames=JU.AU.deleteElements(this.modelNames,a,1);this.frameTitles=JU.AU.deleteElements(this.frameTitles,a,1);this.thisStateModel=-1;var c=this.getInfoM("group3Lists"),f=this.getInfoM("group3Counts"),e=a+1;if(null!=c&&null!=c[e])for(var h=w(c[e].length/6);0<=--h;)0<f[e][h]&&(f[0][h]-=f[e][h],0==f[0][h]&&(c[0]=c[0].substring(0,6*h)+",["+c[0].substring(6*h+2)));null!=c&&(this.msInfo.put("group3Lists",JU.AU.deleteElements(c,a,1)),this.msInfo.put("group3Counts",JU.AU.deleteElements(f,a,1)));
null!=this.unitCells&&(this.unitCells=JU.AU.deleteElements(this.unitCells,a,1));for(h=this.stateScripts.size();0<=--h;)this.stateScripts.get(h).deleteAtoms(a,d,b)||this.stateScripts.removeItemAt(h)}},"~N,JU.BS,JU.BS");c(c$,"setAtomProperty",function(a,b,d,c,f,e,h){switch(b){case 1114249217:case 1112152066:case 1112152071:case 1112152073:case 1112152074:case 1649022989:case 1112152078:if(4<c&&(c=4),null!=e){d=K(this.ac,0);try{var k=a.nextSetBit(0);for(f=0;0<=k;k=a.nextSetBit(k+1))d[k]=e[f++]}catch(j){if(H(j,
Exception))return;throw j;}e=d}case 1112152070:case 1112152076:k=null;d=0;null==e?(16<c&&(c=16.1),0>c&&(c=0),d=w(Math.floor(2E3*c))):k=new J.atomdata.RadiusData(e,0,null,null);this.sm.setShapeSizeBs(JV.JC.shapeTokenIndex(b),d,k,a);return}this.setAPm(a,b,d,c,f,e,h)},"JU.BS,~N,~N,~N,~S,~A,~A");c(c$,"getFileData",function(a){if(0>a)return"";var b=this.getInfo(a,"fileData");if(null!=b)return b;if(!this.getInfoB(a,"isCIF"))return this.getPDBHeader(a);b=this.vwr.getCifData(a);this.setInfo(a,"fileData",
b);return b},"~N");c(c$,"addHydrogens",function(a,b){var d=this.mc-1,c=new JU.BS;if(this.isTrajectory(d)||1<this.am[d].getGroupCount())return c;this.growAtomArrays(this.ac+b.length);var f=this.vwr.rd,e=this.getDefaultMadFromOrder(1);this.am[d].resetDSSR(!1);for(var h=0,k=this.am[d].act+1;h<a.size();h++,k++){var j=a.get(h),z=this.addAtom(d,j.group,1,"H"+k,null,k,j.getSeqID(),k,b[h],NaN,null,0,0,100,NaN,null,!1,0,null,NaN);z.setMadAtom(this.vwr,f);c.set(z.i);this.bondAtoms(j,z,1,e,null,0,!1,!1)}this.sm.loadDefaultShapes(this);
return c},"JU.Lst,~A");c(c$,"mergeModelArrays",function(a){this.at=a.at;this.bo=a.bo;this.stateScripts=a.stateScripts;this.proteinStructureTainted=a.proteinStructureTainted;this.thisStateModel=-1;this.bsSymmetry=a.bsSymmetry;this.modelFileNumbers=a.modelFileNumbers;this.modelNumbersForAtomLabel=a.modelNumbersForAtomLabel;this.modelNames=a.modelNames;this.modelNumbers=a.modelNumbers;this.frameTitles=a.frameTitles;this.haveChirality=a.haveChirality;null!=this.msInfo&&this.msInfo.remove("models");this.mergeAtomArrays(a)},
"JM.ModelSet");c(c$,"getUnitCell",function(a){return 0>a||a>=this.mc?null:null!=this.am[a].simpleCage?this.am[a].simpleCage:null!=this.unitCells&&a<this.unitCells.length&&null!=this.unitCells[a]&&this.unitCells[a].haveUnitCell()?this.unitCells[a]:null!=this.getInfo(a,"unitCellParams")?(null==this.unitCells&&(this.unitCells=Array(this.mc)),this.haveUnitCells=!0,this.unitCells[a]=this.vwr.getSymTemp().setSymmetryInfo(a,this.am[a].auxiliaryInfo,null)):null},"~N");c(c$,"setModelCage",function(a,b){0<=
a&&a<this.mc&&(this.am[a].simpleCage=b,this.haveUnitCells=!0)},"~N,J.api.SymmetryInterface");c(c$,"getModelName",function(a){return 1>this.mc?"":0<=a?this.modelNames[a]:this.modelNumbersForAtomLabel[-1-a]},"~N");c(c$,"getModelTitle",function(a){return this.getInfo(a,"title")},"~N");c(c$,"getModelFileName",function(a){return this.getInfo(a,"fileName")},"~N");c(c$,"getModelFileType",function(a){return this.getInfo(a,"fileType")},"~N");c(c$,"setFrameTitle",function(a,b){if(n(b,String))for(var d=a.nextSetBit(0);0<=
d;d=a.nextSetBit(d+1))this.frameTitles[d]=b;else for(var d=a.nextSetBit(0),c=0;0<=d;d=a.nextSetBit(d+1))c<b.length&&(this.frameTitles[d]=b[c++])},"JU.BS,~O");c(c$,"getFrameTitle",function(a){return 0<=a&&a<this.mc?this.frameTitles[a]:""},"~N");c(c$,"getModelNumberForAtomLabel",function(a){return this.modelNumbersForAtomLabel[a]},"~N");c(c$,"getGroups",function(){for(var a=0,b=0;b<this.mc;b++)a+=this.am[b].getGroupCount();for(var a=Array(a),d=b=0;b<this.mc;b++)for(var c=0;c<this.am[b].chainCount;c++)for(var f=
0;f<this.am[b].chains[c].groupCount;f++)a[d]=this.am[b].chains[c].groups[f],a[d].groupIndex=d,d++;return a});c(c$,"getUnitCellParams",function(){var a=this.getUnitCell(0);return null==a?null:a.getUnitCellParams()});c(c$,"setCrystallographicDefaults",function(){return!this.haveBioModels&&this.someModelsHaveSymmetry&&this.someModelsHaveFractionalCoordinates});c(c$,"getBoundBoxCenter",function(a){return this.isJmolDataFrameForModel(a)?new JU.P3:(null==this.getDefaultBoundBox()?this.boxInfo:this.defaultBBox).getBoundBoxCenter()},
"~N");c(c$,"getBoundBoxCornerVector",function(){return this.boxInfo.getBoundBoxCornerVector()});c(c$,"getBBoxVertices",function(){return this.boxInfo.getBoundBoxVertices()});c(c$,"setBoundBox",function(a,b,d,c){this.isBbcageDefault=!1;this.bboxAtoms=this.bboxModels=null;this.boxInfo.setBoundBox(a,b,d,c)},"JU.T3,JU.T3,~B,~N");c(c$,"getBoundBoxCommand",function(a){if(!a&&null!=this.bboxAtoms)return"boundbox "+JU.Escape.eBS(this.bboxAtoms);this.ptTemp.setT(this.boxInfo.getBoundBoxCenter());var b=this.boxInfo.getBoundBoxCornerVector();
a=a?"boundbox "+JU.Escape.eP(this.ptTemp)+" "+JU.Escape.eP(b)+"\n#or\n":"";this.ptTemp.sub(b);a+="boundbox corners "+JU.Escape.eP(this.ptTemp)+" ";this.ptTemp.scaleAdd2(2,b,this.ptTemp);b=Math.abs(8*b.x*b.y*b.z);return a+=JU.Escape.eP(this.ptTemp)+" # volume = "+b},"~B");c(c$,"findAtomsInRectangle",function(a){for(var b=this.vwr.getVisibleFramesBitSet(),d=new JU.BS,c=this.ac;0<=--c;){var f=this.at[c];null!=f&&(b.get(f.mi)?f.checkVisible()&&a.contains(f.sX,f.sY)&&d.set(c):c=this.am[f.mi].firstAtomIndex)}return d},
"JU.Rectangle");c(c$,"getDefaultVdwType",function(a){return!this.am[a].isBioModel?J.c.VDW.AUTO_BABEL:0==this.am[a].hydrogenCount?J.c.VDW.AUTO_JMOL:J.c.VDW.AUTO_BABEL},"~N");c(c$,"setRotationRadius",function(a,b){return this.isJmolDataFrameForModel(a)?(this.am[a].defaultRotationRadius=b,!1):!0},"~N,~N");c(c$,"calcRotationRadius",function(a,b,d){if(this.isJmolDataFrameForModel(a))return b=this.am[a].defaultRotationRadius,0==b?10:b;if(d&&null!=this.getDefaultBoundBox())return 1.2*(this.defaultBBox.getMaxDim()/
2);d=0;for(var c=this.ac;0<=--c;)if(a=this.at[c],null!=a)if(this.isJmolDataFrameForAtom(a))for(a=a.mi;0<=c&&null!=this.at[c]&&this.at[c].mi==a;)c--;else a=this.at[c],null!=a&&(a=b.distance(a)+this.getRadiusVdwJmol(a),a>d&&(d=a));return 0==d?10:d},"~N,JU.P3,~B");c(c$,"calcBoundBoxDimensions",function(a,b){null!=a&&0>a.nextSetBit(0)&&(a=null);if(!(null==a&&this.isBbcageDefault||0==this.ac)){if(null==this.getDefaultBoundBox())this.bboxModels=this.getModelBS(this.bboxAtoms=JU.BSUtil.copy(a),!1),this.calcAtomsMinMax(a,
this.boxInfo)==this.ac&&(this.isBbcageDefault=!0),null==a&&null!=this.unitCells&&this.calcUnitCellMinMax();else{var d=this.defaultBBox.getBoundBoxVertices();this.boxInfo.reset();for(var c=0;8>c;c++)this.boxInfo.addBoundBoxPoint(d[c])}this.boxInfo.setBbcage(b)}},"JU.BS,~N");c(c$,"getDefaultBoundBox",function(){var a=this.getInfoM("boundbox");null==a?this.defaultBBox=null:(null==this.defaultBBox&&(this.defaultBBox=new JU.BoxInfo),this.defaultBBox.setBoundBoxFromOABC(a));return this.defaultBBox});c(c$,
"getBoxInfo",function(a,b){if(null==a)return this.boxInfo;var d=new JU.BoxInfo;this.calcAtomsMinMax(a,d);d.setBbcage(b);return d},"JU.BS,~N");c(c$,"calcAtomsMinMax",function(a,b){b.reset();for(var d=0,c=null==a,f=c?this.ac-1:a.nextSetBit(0);0<=f;f=c?f-1:a.nextSetBit(f+1)){d++;var e=this.at[f];null!=e&&!this.isJmolDataFrameForAtom(e)&&b.addBoundBoxPoint(e)}return d},"JU.BS,JU.BoxInfo");c(c$,"calcUnitCellMinMax",function(){for(var a=new JU.P3,b=0;b<this.mc;b++)if(this.unitCells[b].getCoordinatesAreFractional())for(var d=
this.unitCells[b].getUnitCellVerticesNoOffset(),c=this.unitCells[b].getCartesianOffset(),f=0;8>f;f++)a.add2(c,d[f]),this.boxInfo.addBoundBoxPoint(a)});c(c$,"calcRotationRadiusBs",function(a){for(var b=this.getAtomSetCenter(a),d=0,c=a.nextSetBit(0);0<=c;c=a.nextSetBit(c+1)){var f=this.at[c],f=b.distance(f)+this.getRadiusVdwJmol(f);f>d&&(d=f)}return 0==d?10:d},"JU.BS");c(c$,"getCenterAndPoints",function(a,b){for(var d,c,f=b?1:0,e=a.size();0<=--e;){var h=a.get(e);d=h[0];n(h[1],JU.BS)?(c=h[1],f+=Math.min(d.cardinality(),
c.cardinality())):f+=Math.min(d.cardinality(),h[1].length)}var k=u(2,f,null);b&&(k[0][0]=new JU.P3,k[1][0]=new JU.P3);for(e=a.size();0<=--e;)if(h=a.get(e),d=h[0],n(h[1],JU.BS)){c=h[1];for(var h=d.nextSetBit(0),j=c.nextSetBit(0);0<=h&&0<=j;h=d.nextSetBit(h+1),j=c.nextSetBit(j+1))k[0][--f]=this.at[h],k[1][f]=this.at[j],b&&(k[0][0].add(this.at[h]),k[1][0].add(this.at[j]))}else{c=h[1];h=d.nextSetBit(0);for(j=0;0<=h&&j<c.length;h=d.nextSetBit(h+1),j++)k[0][--f]=this.at[h],k[1][f]=c[j],b&&(k[0][0].add(this.at[h]),
k[1][0].add(c[j]))}b&&(k[0][0].scale(1/(k[0].length-1)),k[1][0].scale(1/(k[1].length-1)));return k},"JU.Lst,~B");c(c$,"getAtomSetCenter",function(a){for(var b=new JU.P3,d=0,c=a.nextSetBit(0);0<=c;c=a.nextSetBit(c+1))this.isJmolDataFrameForAtom(this.at[c])||(d++,b.add(this.at[c]));1<d&&b.scale(1/d);return b},"JU.BS");c(c$,"getAverageAtomPoint",function(){return this.getAtomSetCenter(this.vwr.bsA())});c(c$,"setAPm",function(a,b,d,c,f,e,h){this.setAPa(a,b,d,c,f,e,h);switch(b){case 1094715417:case 1631586315:this.vwr.getBoolean(603979944)&&
this.assignAromaticBondsBs(!0,null)}},"JU.BS,~N,~N,~N,~S,~A,~A");c(c$,"addStateScript",function(a,b,d,c,f,e,h){var k=this.vwr.am.cmi;e?(this.thisStateModel!=k&&(a="frame "+(0>k?"all #"+k:this.getModelNumberDotted(k))+";\n  "+a),this.thisStateModel=k):this.thisStateModel=-1;a=new JM.StateScript(this.thisStateModel,a,b,d,c,f,h);a.isValid()&&this.stateScripts.addLast(a);return a},"~S,JU.BS,JU.BS,JU.BS,~S,~B,~B");c(c$,"freezeModels",function(){this.haveBioModels=!1;for(var a=this.mc;0<=--a;)this.haveBioModels=
(new Boolean(this.haveBioModels|this.am[a].freeze())).valueOf()});c(c$,"getStructureList",function(){return this.vwr.getStructureList()});c(c$,"getInfoM",function(a){return null==this.msInfo?null:this.msInfo.get(a)},"~S");c(c$,"getMSInfoB",function(a){a=this.getInfoM(a);return n(a,Boolean)&&a.booleanValue()},"~S");c(c$,"isTrajectory",function(a){return this.am[a].isTrajectory},"~N");c(c$,"isTrajectorySubFrame",function(a){return this.am[a].trajectoryBaseIndex!=a},"~N");c(c$,"isTrajectoryMeasurement",
function(a){return null!=this.trajectory&&this.trajectory.hasMeasure(a)},"~A");c(c$,"getModelBS",function(a,b){var d=new JU.BS,c=0,f=null==a;b=(new Boolean(b&null!=this.trajectory)).valueOf();for(var e=f?0:a.nextSetBit(0);0<=e&&e<this.ac;e=f?e+1:a.nextSetBit(e+1))null!=this.at[e]&&(d.set(c=this.at[e].mi),b&&this.trajectory.getModelBS(c,d),c=this.am[c],c.isOrderly&&(e=c.firstAtomIndex+c.act-1));return d},"JU.BS,~B");c(c$,"getIterativeModels",function(a){for(var b=new JU.BS,d=0;d<this.mc;d++)if(a||
!this.isJmolDataFrameForModel(d))this.isTrajectorySubFrame(d)||b.set(d);return b},"~B");c(c$,"fillAtomData",function(a,b){if(0!=(b&4)){this.getMolecules();a.bsMolecules=Array(this.molecules.length);a.atomMolecule=B(this.ac,0);for(var d,c=0;c<this.molecules.length;c++){d=a.bsMolecules[c]=this.molecules[c].atomList;for(var f=d.nextSetBit(0);0<=f;f=d.nextSetBit(f+1))a.atomMolecule[f]=c}}0!=(b&8)?(d=B(1,0),a.hAtomRadius=this.vwr.getVanderwaalsMar(1)/1E3,a.hAtoms=this.calculateHydrogens(a.bsSelected,d,
null,512),a.hydrogenAtomCount=d[0]):(a.firstAtomIndex=0>a.modelIndex?null==a.bsSelected?0:Math.max(0,a.bsSelected.nextSetBit(0)):this.am[a.modelIndex].firstAtomIndex,a.lastModelIndex=a.firstModelIndex=0==this.ac?0:this.at[a.firstAtomIndex].mi,a.modelName=this.getModelNumberDotted(a.firstModelIndex),this.fillADa(a,b))},"J.atomdata.AtomData,~N");c(c$,"getModelNumberDotted",function(a){return 1>this.mc||a>=this.mc||0>a?"":JU.Escape.escapeModelFileNumber(this.modelFileNumbers[a])},"~N");c(c$,"getModelNumber",
function(a){return this.modelNumbers[2147483647==a?this.mc-1:a]},"~N");c(c$,"getModelProperty",function(a,b){var d=this.am[a].properties;return null==d?null:d.getProperty(b)},"~N,~S");c(c$,"getModelAuxiliaryInfo",function(a){return 0>a?null:this.am[a].auxiliaryInfo},"~N");c(c$,"setInfo",function(a,b,d){0<=a&&a<this.mc&&this.am[a].auxiliaryInfo.put(b,d)},"~N,~O,~O");c(c$,"getInfo",function(a,b){return 0>a?null:this.am[a].auxiliaryInfo.get(b)},"~N,~S");c(c$,"getInfoB",function(a,b){var d=this.am[a].auxiliaryInfo;
return null!=d&&d.containsKey(b)&&d.get(b).booleanValue()},"~N,~S");c(c$,"getInfoI",function(a,b){var d=this.am[a].auxiliaryInfo;return null!=d&&d.containsKey(b)?d.get(b).intValue():-2147483648},"~N,~S");c(c$,"getInsertionCountInModel",function(a){return this.am[a].insertionCount},"~N");c$.modelFileNumberFromFloat=c(c$,"modelFileNumberFromFloat",function(a){var b=w(Math.floor(a));for(a=w(Math.floor(1E4*(a-b+1E-5)));0!=a&&0==a%10;)a/=10;return 1E6*b+a},"~N");c(c$,"getChainCountInModelWater",function(a,
b){if(0>a){for(var d=0,c=this.mc;0<=--c;)d+=this.am[c].getChainCount(b);return d}return this.am[a].getChainCount(b)},"~N,~B");c(c$,"getGroupCountInModel",function(a){if(0>a){a=0;for(var b=this.mc;0<=--b;)a+=this.am[b].getGroupCount();return a}return this.am[a].getGroupCount()},"~N");c(c$,"calcSelectedGroupsCount",function(){for(var a=this.vwr.bsA(),b=this.mc;0<=--b;)this.am[b].calcSelectedGroupsCount(a)});c(c$,"isJmolDataFrameForModel",function(a){return 0<=a&&a<this.mc&&this.am[a].isJmolDataFrame},
"~N");c(c$,"isJmolDataFrameForAtom",function(a){return this.am[a.mi].isJmolDataFrame},"JM.Atom");c(c$,"setJmolDataFrame",function(a,b,d){var c=this.am[null==a?this.am[d].dataSourceFrame:b];null==a&&(a=this.am[d].jmolFrameType);0<=b&&(null==c.dataFrames&&(c.dataFrames=new java.util.Hashtable),this.am[d].dataSourceFrame=b,this.am[d].jmolFrameType=a,c.dataFrames.put(a,Integer.$valueOf(d)));a.startsWith("quaternion")&&0>a.indexOf("deriv")&&(a=a.substring(0,a.indexOf(" ")),c.dataFrames.put(a,Integer.$valueOf(d)))},
"~S,~N,~N");c(c$,"getJmolDataFrameIndex",function(a,b){if(null==this.am[a].dataFrames)return-1;var d=this.am[a].dataFrames.get(b);return null==d?-1:d.intValue()},"~N,~S");c(c$,"clearDataFrameReference",function(a){for(var b=0;b<this.mc;b++){var d=this.am[b].dataFrames;if(null!=d)for(d=d.values().iterator();d.hasNext();)d.next().intValue()==a&&d.remove()}},"~N");c(c$,"getJmolFrameType",function(a){return 0<=a&&a<this.mc?this.am[a].jmolFrameType:"modelSet"},"~N");c(c$,"getJmolDataSourceFrame",function(a){return 0<=
a&&a<this.mc?this.am[a].dataSourceFrame:-1},"~N");c(c$,"saveModelOrientation",function(a,b){this.am[a].orientation=b},"~N,JM.Orientation");c(c$,"getModelOrientation",function(a){return this.am[a].orientation},"~N");c(c$,"getPDBHeader",function(a){return this.am[a].isBioModel?this.am[a].getFullPDBHeader():this.getFileHeader(a)},"~N");c(c$,"getFileHeader",function(a){if(0>a)return"";if(this.am[a].isBioModel)return this.getPDBHeader(a);a=this.getInfo(a,"fileHeader");null==a&&(a=this.modelSetName);return null!=
a?a:"no header information found"},"~N");c(c$,"getAltLocCountInModel",function(a){return this.am[a].altLocCount},"~N");c(c$,"getAltLocIndexInModel",function(a,b){if("\x00"==b)return 0;var d=this.getAltLocListInModel(a);return 0==d.length?0:d.indexOf(b)+1},"~N,~S");c(c$,"getInsertionCodeIndexInModel",function(a,b){if("\x00"==b)return 0;var d=this.getInsertionListInModel(a);return 0==d.length?0:d.indexOf(b)+1},"~N,~S");c(c$,"getAltLocListInModel",function(a){a=this.getInfo(a,"altLocs");return null==
a?"":a},"~N");c(c$,"getInsertionListInModel",function(a){a=this.getInfo(a,"insertionCodes");return null==a?"":a},"~N");c(c$,"getModelSymmetryCount",function(a){return 0<this.am[a].biosymmetryCount?this.am[a].biosymmetryCount:null==this.unitCells||null==this.unitCells[a]?0:this.unitCells[a].getSpaceGroupOperationCount()},"~N");c(c$,"getModelCellRange",function(a){return null==this.unitCells?null:this.unitCells[a].getCellRange()},"~N");c(c$,"getLastVibrationVector",function(a,b){if(null!=this.vibrations&&
a<this.vwr.ms.mc)for(var d,c=0>a||this.isTrajectory(a)||a>=this.mc-1?this.ac:this.am[a+1].firstAtomIndex,f=0>=a?0:this.am[a].firstAtomIndex;--c>=f;)if((0>a||this.at[c].mi==a)&&((1275072532==b||0==b)&&null!=(d=this.getModulation(c))||(4166==b||0==b)&&null!=(d=this.getVibration(c,!1)))&&d.isNonzero())return c;return-1},"~N,~N");c(c$,"getModulationList",function(a,b,d){var c=new JU.Lst;if(null!=this.vibrations)for(var f=a.nextSetBit(0);0<=f;f=a.nextSetBit(f+1))n(this.vibrations[f],J.api.JmolModulationSet)?
c.addLast(this.vibrations[f].getModulation(b,d)):c.addLast(Float.$valueOf("O"==b?NaN:-1));return c},"JU.BS,~S,JU.P3");c(c$,"getElementsPresentBitSet",function(a){if(0<=a)return this.elementsPresent[a];a=new JU.BS;for(var b=0;b<this.mc;b++)a.or(this.elementsPresent[b]);return a},"~N");c(c$,"getMoleculeIndex",function(a,b){0==this.moleculeCount&&this.getMolecules();for(var d=0;d<this.moleculeCount;d++)if(this.molecules[d].atomList.get(a))return b?this.molecules[d].indexInModel:d;return 0},"~N,~B");
c(c$,"getMoleculeBitSet",function(a){0==this.moleculeCount&&this.getMolecules();var b=JU.BSUtil.copy(a);a=JU.BSUtil.copy(a);for(var d=0,c=new JU.BS;0<=(d=a.length()-1);)c=this.getMoleculeBitSetForAtom(d),null==c?(a.clear(d),b.clear(d)):(a.andNot(c),b.or(c));return b},"JU.BS");c(c$,"getMoleculeBitSetForAtom",function(a){0==this.moleculeCount&&this.getMolecules();for(var b=0;b<this.moleculeCount;b++)if(this.molecules[b].atomList.get(a))return this.molecules[b].atomList;return null},"~N");c(c$,"getModelDipole",
function(a){if(0>a)return null;var b=this.getInfo(a,"dipole");null==b&&(b=this.getInfo(a,"DIPOLE_VEC"));return b},"~N");c(c$,"calculateMolecularDipole",function(a,b){if(null!=b){var d=b.nextSetBit(0);if(0>d)return null;a=this.at[d].mi}if(0>a)return null;var c=d=0,f=0,e=0,h=new JU.V3,k=new JU.V3;null==b&&(b=this.getModelAtomBitSetIncludingDeleted(-1,!1));this.vwr.getOrCalcPartialCharges(this.am[a].bsAtoms,null);for(var j=b.nextSetBit(0);0<=j;j=b.nextSetBit(j+1))if(!(this.at[j].mi!=a||this.at[j].isDeleted())){var z=
this.partialCharges[j];0>z?(c++,e+=z,k.scaleAdd2(z,this.at[j],k)):0<z&&(d++,f+=z,h.scaleAdd2(z,this.at[j],h))}if(0.015<Math.abs(f+e))return JU.Logger.info("Dipole calculation requires balanced charges: "+f+" "+e),null;if(0==c||0==d)return null;h.add(k);h.scale(4.8);return h},"~N,JU.BS");c(c$,"getMoleculeCountInModel",function(a){var b=0;0==this.moleculeCount&&this.getMolecules();if(0>a)return this.moleculeCount;for(var d=0;d<this.mc;d++)a==d&&(b+=this.am[d].moleculeCount);return b},"~N");c(c$,"calcSelectedMoleculesCount",
function(){var a=this.vwr.bsA();0==this.moleculeCount&&this.getMolecules();this.selectedMolecules.xor(this.selectedMolecules);for(var b=new JU.BS,d=0;d<this.moleculeCount;d++)JU.BSUtil.copy2(a,b),b.and(this.molecules[d].atomList),0<b.length()&&this.selectedMolecules.set(d)});c(c$,"setCentroid",function(a,b){var d=this.getNotInCentroid(a,b);null!=d&&0<=d.nextSetBit(0)&&this.vwr.deleteAtoms(d,!1)},"JU.BS,~A");c(c$,"getNotInCentroid",function(a,b){var d=a.nextSetBit(0);if(0>d)return null;d=this.getUnitCell(this.at[d].mi);
return null==d?null:d.notInCentroid(this,a,b)},"JU.BS,~A");c(c$,"getMolecules",function(){if(0<this.moleculeCount)return this.molecules;null==this.molecules&&(this.molecules=Array(4));this.moleculeCount=0;for(var a=null,b=Array(this.mc),d=null,c=0;c<this.mc;c++)b[c]=this.vwr.getModelUndeletedAtomsBitSet(c),a=this.am[c],a.moleculeCount=0,d=a.isBioModel?a.getBioBranches(d):null;this.molecules=JU.JmolMolecule.getMolecules(this.at,b,d,null);for(c=this.moleculeCount=this.molecules.length;0<=--c;)a=this.am[this.molecules[c].modelIndex],
a.firstMoleculeIndex=c,a.moleculeCount++;return this.molecules});c(c$,"initializeBspf",function(){if(!(null!=this.bspf&&this.bspf.isValid)){this.showRebondTimes&&JU.Logger.startTimer("build bspf");var a=new J.bspt.Bspf(3);JU.Logger.debugging&&JU.Logger.debug("sequential bspt order");for(var b=JU.BS.newN(this.mc),d=this.ac;0<=--d;){var c=this.at[d];null!=c&&(!c.isDeleted()&&!this.isTrajectorySubFrame(c.mi))&&(a.addTuple(this.am[c.mi].trajectoryBaseIndex,c),b.set(c.mi))}this.showRebondTimes&&(JU.Logger.checkTimer("build bspf",
!1),a.stats());for(d=b.nextSetBit(0);0<=d;d=b.nextSetBit(d+1))a.validateModel(d,!0);a.isValid=!0;this.bspf=a}});c(c$,"initializeBspt",function(a){this.initializeBspf();this.bspf.isInitializedIndex(a)||this.bspf.initialize(a,this.at,this.vwr.getModelUndeletedAtomsBitSet(a))},"~N");c(c$,"setIteratorForPoint",function(a,b,d,c){0>b?a.setCenter(d,c):(this.initializeBspt(b),a.setModel(this,b,this.am[b].firstAtomIndex,2147483647,d,c,null))},"J.api.AtomIndexIterator,~N,JU.T3,~N");c(c$,"setIteratorForAtom",
function(a,b,d,c,f){0>b&&(b=this.at[d].mi);b=this.am[b].trajectoryBaseIndex;this.initializeBspt(b);a.setModel(this,b,this.am[b].firstAtomIndex,d,this.at[d],c,f)},"J.api.AtomIndexIterator,~N,~N,~N,J.atomdata.RadiusData");c(c$,"getSelectedAtomIterator",function(a,b,d,c,f){this.initializeBspf();if(f){f=this.getModelBS(a,!1);for(var e=f.nextSetBit(0);0<=e;e=f.nextSetBit(e+1))this.initializeBspt(e);f=new JM.AtomIteratorWithinModelSet(f)}else f=new JM.AtomIteratorWithinModel;f.initialize(this.bspf,a,b,
d,c,this.vwr.isParallel());return f},"JU.BS,~B,~B,~B,~B");j(c$,"getBondCountInModel",function(a){return 0>a?this.bondCount:this.am[a].getBondCount()},"~N");c(c$,"getAtomCountInModel",function(a){return 0>a?this.ac:this.am[a].act},"~N");c(c$,"getModelAtomBitSetIncludingDeletedBs",function(a){var b=new JU.BS;null==a&&null==this.bsAll&&(this.bsAll=JU.BSUtil.setAll(this.ac));if(null==a)b.or(this.bsAll);else for(var d=a.nextSetBit(0);0<=d;d=a.nextSetBit(d+1))b.or(this.getModelAtomBitSetIncludingDeleted(d,
!1));return b},"JU.BS");c(c$,"getModelAtomBitSetIncludingDeleted",function(a,b){var d=0>a?this.bsAll:this.am[a].bsAtoms;null==d&&(d=this.bsAll=JU.BSUtil.setAll(this.ac));return b?JU.BSUtil.copy(d):d},"~N,~B");c(c$,"getAtomBitsMaybeDeleted",function(a,b){var d;switch(a){default:return this.getAtomBitsMDa(a,b,new JU.BS);case 1073741925:case 1073742189:case 1111490587:case 1073742128:case 1073741863:case 1086324744:return d=new JU.BS,this.haveBioModels?this.bioModelset.getAtomBitsStr(a,b,d):d;case 1677721602:case 1073742331:return this.getAtomBitsMDb(a,
b);case 1678381065:var c=this.getBoxInfo(b,1);d=this.getAtomsWithin(c.getBoundBoxCornerVector().length()+1E-4,c.getBoundBoxCenter(),null,-1);for(var f=d.nextSetBit(0);0<=f;f=d.nextSetBit(f+1))c.isWithin(this.at[f])||d.clear(f);return d;case 1094713349:d=new JU.BS;for(f=this.ac;0<=--f;)null!=this.at[f]&&this.isInLatticeCell(f,b,this.ptTemp2,!1)&&d.set(f);return d;case 1094713350:d=JU.BSUtil.newBitSet2(0,this.ac);c=B(-1,[A(b.x)-1,A(b.y)-1,A(b.z)-1,A(b.x),A(b.y),A(b.z),0]);for(f=this.mc;0<=--f;){var e=
this.getUnitCell(f);null==e?JU.BSUtil.andNot(d,this.am[f].bsAtoms):d.andNot(e.notInCentroid(this,this.am[f].bsAtoms,c))}return d;case 1094713360:return this.getMoleculeBitSet(b);case 1073742363:return this.getSelectCodeRange(b);case 2097196:d=JU.BS.newN(this.ac);c=-1;e=0;for(f=this.ac;0<=--f;){var h=this.at[f];if(null!=h){var j=h.atomSymmetry;if(null!=j){if(h.mi!=c){c=h.mi;if(null==this.getModelCellRange(c))continue;e=this.getModelSymmetryCount(c)}for(var h=0,l=e;0<=--l;)if(j.get(l)&&1<++h){d.set(f);
break}}}}return d;case 1088421903:return JU.BSUtil.copy(null==this.bsSymmetry?this.bsSymmetry=JU.BS.newN(this.ac):this.bsSymmetry);case 1814695966:d=new JU.BS;if(null==this.vwr.getCurrentUnitCell())return d;this.ptTemp1.set(1,1,1);for(f=this.ac;0<=--f;)null!=this.at[f]&&this.isInLatticeCell(f,this.ptTemp1,this.ptTemp2,!1)&&d.set(f);return d}},"~N,~O");c(c$,"getSelectCodeRange",function(a){var b=new JU.BS,d=a[0],c=a[1];a=a[2];var f=this.vwr.getBoolean(603979822);0<=a&&(300>a&&!f)&&(a=this.chainToUpper(a));
for(var e=this.mc;0<=--e;)if(this.am[e].isBioModel)for(var h=this.am[e],j,l=h.chainCount;0<=--l;){var z=h.chains[l];if(-1==a||a==(j=z.chainID)||!f&&0<j&&300>j&&a==this.chainToUpper(j))for(var m=z.groups,z=z.groupCount,r=0;0<=r;)r=JM.ModelSet.selectSeqcodeRange(m,z,r,d,c,b)}return b},"~A");c$.selectSeqcodeRange=c(c$,"selectSeqcodeRange",function(a,b,d,c,f,e){var h,j,l,z=!1;for(j=d;j<b&&a[j].seqcode!=c;j++);if(j==b){if(0<d)return-1;z=!0;l=2147483647;for(var m=b;0<=--m;)if((h=a[m].seqcode)>c&&h-c<l)j=
m,l=h-c;if(2147483647==l)return-1}if(2147483647==f)c=b-1,z=!0;else{for(c=j;c<b&&a[c].seqcode!=f;c++);if(c==b){if(0<d)return-1;z=!0;l=2147483647;for(m=j;m<b;m++)if((h=a[m].seqcode)<f&&f-h<l)c=m,l=f-h;if(2147483647==l)return-1}}for(m=j;m<=c;++m)a[m].setAtomBits(e);return z?-1:c+1},"~A,~N,~N,~N,~N,JU.BS");c(c$,"isInLatticeCell",function(a,b,d,c){var f=this.getUnitCell(this.at[a].mi);d.setT(this.at[a]);return null!=f&&f.checkUnitCell(f,b,d,c)},"~N,JU.P3,JU.P3,~B");c(c$,"getAtomsWithinRadius",function(a,
b,d,c){var f=new JU.BS,e=this.getIterativeModels(!1);b=JU.BSUtil.andNot(b,this.vwr.slm.bsDeleted);var h=this.getSelectedAtomIterator(null,!1,!1,!1,!1);if(d){d=!this.vwr.g.legacyJavaFloat;for(var j=new JU.P3,l=b.nextSetBit(0);0<=l;l=b.nextSetBit(l+1))for(var z=this.mc;0<=--z;)e.get(z)&&(0>a?this.getAtomsWithin(a,this.at[l].getFractionalUnitCoordPt(d,!0,j),f,-1):(this.setIteratorForAtom(h,z,l,a,c),h.addAtoms(f)))}else{f.or(b);for(l=b.nextSetBit(0);0<=l;l=b.nextSetBit(l+1))0>a?this.getAtomsWithin(a,
this.at[l],f,this.at[l].mi):(this.setIteratorForAtom(h,-1,l,a,c),h.addAtoms(f))}h.release();return f},"~N,JU.BS,~B,J.atomdata.RadiusData");c(c$,"getAtomsWithin",function(a,b,d,c){null==d&&(d=new JU.BS);if(0>a){a=-a;for(var f=this.ac;0<=--f;){var e=this.at[f];null==e||0<=c&&e.mi!=c||!d.get(f)&&e.getFractionalUnitDistance(b,this.ptTemp1,this.ptTemp2)<=a&&d.set(e.i)}return d}c=this.getIterativeModels(!0);f=this.getSelectedAtomIterator(null,!1,!1,!1,!1);for(e=this.mc;0<=--e;)c.get(e)&&!this.am[e].bsAtoms.isEmpty()&&
(this.setIteratorForAtom(f,-1,this.am[e].firstAtomIndex,-1,null),f.setCenter(b,a),f.addAtoms(d));f.release();return d},"~N,JU.T3,JU.BS,~N");c(c$,"deleteBonds",function(a,b){if(!b)for(var d=new JU.BS,c=new JU.BS,f=a.nextSetBit(0);0<=f;f=a.nextSetBit(f+1)){var e=this.bo[f].atom1;this.am[e.mi].isModelKit||(d.clearAll(),c.clearAll(),d.set(e.i),c.set(this.bo[f].getAtomIndex2()),this.addStateScript("connect ",null,d,c,"delete",!1,!0))}this.dBb(a,b)},"JU.BS,~B");c(c$,"makeConnections2",function(a,b,d,c,
f,e,h,j,l,z){null==h&&(h=new JU.BS);var m=65535==d,r=131071==d,p=65537==d;r&&(d=1);var n=JU.Edge.isOrderH(d),q=!1,s=!1,u=!1,t=!1;switch(c){case 12291:return this.deleteConnections(a,b,d,f,e,j,r);case 603979872:case 1073741852:if(515!=d){if(j){a=f;f=new JU.BS;e=new JU.BS;for(var v=a.nextSetBit(0);0<=v;v=a.nextSetBit(v+1))f.set(this.bo[v].atom1.i),e.set(this.bo[v].atom2.i)}return B(-1,[n?this.autoHbond(f,e,!1):this.autoBondBs4(f,e,null,h,this.vwr.getMadBond(),603979872==c),0])}s=t=!0;break;case 1086324745:q=
s=!0;break;case 1073742025:s=!0;break;case 1073741904:u=!0}c=!q||m;m=!q&&!m;this.defaultCovalentMad=this.vwr.getMadBond();var r=0>a,w=0>b,A=r||w,D=!j||0.1!=a||1E8!=b;D&&(a=this.fixD(a,r),b=this.fixD(b,w));var G=this.getDefaultMadFromOrder(d),E=0,K=0,I=null,L=null,M=null,N="\x00",O=d|131072,Q=0!=(d&512);try{for(v=f.nextSetBit(0);0<=v;v=f.nextSetBit(v+1)){if(j)I=this.bo[v],L=I.atom1,M=I.atom2;else{L=this.at[v];if(L.isDeleted())continue;N=this.isModulated(v)?"\x00":L.altloc}for(var P=j?0:e.nextSetBit(0);0<=
P;P=e.nextSetBit(P+1)){if(j)P=2147483646;else{if(P==v)continue;M=this.at[P];if(null==M||L.mi!=M.mi||M.isDeleted())continue;if("\x00"!=N&&N!=M.altloc&&"\x00"!=M.altloc)continue;I=L.getBond(M)}if(!(null==I?s:u)&&!(D&&!this.isInRange(L,M,a,b,r,w,A)||Q&&!this.allowAromaticBond(I)))if(null==I)h.set(this.bondAtoms(L,M,d,G,h,z,l,!0).index),E++;else if(m&&(I.setOrder(d),p&&(this.haveAtropicBonds=!0,I.setAtropisomerOptions(f,e)),this.bsAromatic.clear(I.index)),c||d==I.order||O==I.order||n&&I.isHydrogen())h.set(I.index),
K++}}}catch(R){if(!H(R,Exception))throw R;}t&&this.assignAromaticBondsBs(!0,h);q||this.sm.setShapeSizeBs(1,-2147483648,null,h);return B(-1,[E,K])},"~N,~N,~N,~N,JU.BS,JU.BS,JU.BS,~B,~B,~N");c(c$,"autoBondBs4",function(a,b,d,c,f,e){if(e)return this.autoBond_Pre_11_9_24(a,b,d,c,f);if(0==this.ac)return 0;0==f&&(f=1);1.4E-45==this.maxBondingRadius&&this.findMaxRadii();e=this.vwr.getFloat(570425348);var h=this.vwr.getFloat(570425364),h=h*h,j=0;this.showRebondTimes&&JU.Logger.startTimer("autobond");var l=
-1,z=null==a,m,r;z?(r=0,m=null):(a.equals(b)?m=a:(m=JU.BSUtil.copy(a),m.or(b)),r=m.nextSetBit(0));for(var p=this.getSelectedAtomIterator(null,!1,!1,!0,!1),n=!1;0<=r&&r<this.ac;r=z?r+1:m.nextSetBit(r+1)){var q=z||a.get(r),s=z||b.get(r),u=this.at[r];if(!(null==u||u.isDeleted())){var t=u.mi;if(t!=l){l=t;if(this.isJmolDataFrameForModel(t)){r=this.am[t].firstAtomIndex+this.am[t].act-1;continue}n=this.getInfoB(t,"autoBondUsingOccupation")}t=u.getBondingRadius();if(0!=t){var v=u.getFormalCharge(),w=0!=v;
w&&(v=Math.signum(v));var A=null!=d&&d.get(r);for(this.setIteratorForAtom(p,-1,r,t+this.maxBondingRadius+e,null);p.hasNext();){var B=this.at[p.next()];if(!B.isDeleted()){var D=B.i,G=z||a.get(D),E=z||b.get(D);!G&&!E||(!(q&&E||s&&G)||A&&d.get(D)||n&&null!=this.occupancies&&50>this.occupancies[r]!=50>this.occupancies[D]||w&&Math.signum(B.getFormalCharge())==v)||(D=this.isBondable(t,B.getBondingRadius(),p.foundDistance2(),h,e)?1:0,0<D&&this.autoBondCheck(u,B,D,f,c)&&j++)}}p.release()}}}this.showRebondTimes&&
JU.Logger.checkTimer("autoBond",!1);return j},"JU.BS,JU.BS,JU.BS,JU.BS,~N,~B");c(c$,"isBondable",function(a,b,d,c,f){if(0==a||0==b||d<c)return!1;a=a+b+f;return d<=a*a},"~N,~N,~N,~N,~N");c(c$,"autoBondCheck",function(a,b,d,c,f){if(20<a.getCurrentBondCount()||20<b.getCurrentBondCount())return this.maxBondWarned||JU.Logger.warn("maximum auto bond count reached"),this.maxBondWarned=!0,!1;var e=a.getFormalCharge();if(0!=e){var h=b.getFormalCharge();if(0>e&&0>h||0<e&&0<h)return!1}if(a.altloc!=b.altloc&&
"\x00"!=a.altloc&&"\x00"!=b.altloc&&null==this.getModulation(a.i))return!1;this.getOrAddBond(a,b,d,c,f,0,!1);return!0},"JM.Atom,JM.Atom,~N,~N,JU.BS");c(c$,"autoBond_Pre_11_9_24",function(a,b,d,c,f){if(0==this.ac)return 0;0==f&&(f=1);1.4E-45==this.maxBondingRadius&&this.findMaxRadii();var e=this.vwr.getFloat(570425348),h=this.vwr.getFloat(570425364),h=h*h,j=0;this.initializeBspf();for(var l=-1,z=this.ac;0<=--z;){var m=this.at[z];if(null!=m){var r=null==a||a.get(z),p=null==b||b.get(z);if((r||p)&&!m.isDeleted()){var n=
m.mi;if(n!=l&&(l=n,this.isJmolDataFrameForModel(n))){for(;0<=--z&&!(null==this.at[z]||this.at[z].mi!=n););z++;continue}var q=m.getBondingRadius();if(0!=q){var s=q+this.maxBondingRadius+e;this.initializeBspt(n);n=this.bspf.getCubeIterator(n);for(n.initialize(m,s,!0);n.hasMoreElements();)if(s=n.nextElement(),!(s===m||s.isDeleted())){var t=s.i,u=null==a||a.get(t),v=null==b||b.get(t);if(!(!u&&!v||null!=d&&d.get(t)&&d.get(z)))if(r&&v||p&&u)t=this.isBondable(q,s.getBondingRadius(),n.foundDistance2(),h,
e)?1:0,0<t&&this.autoBondCheck(m,s,t,f,c)&&j++}n.release()}}}}return j},"JU.BS,JU.BS,JU.BS,JU.BS,~N");c(c$,"autoHbond",function(a,b,d){if(d){for(var c=this.getModelBS(a,!1),f=c.nextSetBit(0);0<=f&&d;f=c.nextSetBit(f+1))d=!this.am[f].hasRasmolHBonds;if(d)return 0}d=!1;for(f=a.nextSetBit(0);0<=f;f=a.nextSetBit(f+1))if(1==this.at[f].getElementNumber()){d=!0;break}c=new JU.BS;f=this.vwr.getBoolean(603979853);if(null==b||f&&!d)return JU.Logger.info((null==b?"DSSP/DSSR ":"RasMol")+" pseudo-hbond calculation"),
this.calcRasmolHydrogenBonds(a,b,null,!1,2147483647,!1,c),-c.cardinality();JU.Logger.info(d?"Standard Hbond calculation":"Jmol pseudo-hbond calculation");var e=null;if(!d){e=new JU.BS;for(f=a.nextSetBit(0);0<=f;f=a.nextSetBit(f+1))switch(this.at[f].atomID){case 64:case 4:case 14:case 15:case 16:case 17:e.set(f)}}var h,j;d?(h=this.vwr.getFloat(570425361),j=1):(h=this.vwr.getFloat(570425360),j=JM.ModelSet.hbondMinRasmol*JM.ModelSet.hbondMinRasmol);var l=h*h,z=3.141592653589793*this.vwr.getFloat(570425359)/
180,m=0,r=0,n=new JU.V3,p=new JU.V3;this.showRebondTimes&&JU.Logger.debugging&&JU.Logger.startTimer("hbond");var q=null,s=null;b=this.getSelectedAtomIterator(b,!1,!1,!1,!1);for(f=a.nextSetBit(0);0<=f;f=a.nextSetBit(f+1)){var t=this.at[f],u=t.getElementNumber(),v=1==u;if(!(v?!d:d||7!=u&&8!=u)){if(v){var u=!1,w=t.bonds;if(null==w)continue;for(var A=!1,B=0;!A&&B<w.length;B++)A=w[B].getOtherAtom(t).getElementNumber(),A=7==A||8==A;if(!A)continue}else u=e.get(f);for(this.setIteratorForAtom(b,-1,t.i,h,null);b.hasNext();)if(w=
this.at[b.next()],B=w.getElementNumber(),!(w===t||(v?1==B:7!=B&&8!=B)||(r=b.foundDistance2())<j||r>l||u&&e.get(w.i)||t.isBonded(w))){if(0<z){n.sub2(t,w);if(null==(s=JM.ModelSet.checkMinAttachedAngle(t,z,n,p,d)))continue;n.scale(-1);if(null==(q=JM.ModelSet.checkMinAttachedAngle(w,z,n,p,d)))continue}B=0;v&&!Float.isNaN(q.x)&&!Float.isNaN(s.x)?(A=4096,B=JM.HBond.getEnergy(Math.sqrt(r),q.distance(t),q.distance(s),w.distance(s))/1E3):A=2048;c.set(this.addHBond(t,w,A,B));m++}}}b.release();this.sm.setShapeSizeBs(1,
-2147483648,null,c);this.showRebondTimes&&JU.Logger.checkTimer("hbond",!1);return d?m:-m},"JU.BS,JU.BS,~B");c$.checkMinAttachedAngle=c(c$,"checkMinAttachedAngle",function(a,b,d,c,f){var e=a.bonds,h=!0,j=null;if(null!=e&&0<e.length)for(var l=3.4028235E38,z=e.length;0<=--z;)if(e[z].isCovalent()){var h=!1,m=e[z].getOtherAtom(a);if(f||1!=m.getElementNumber()){c.sub2(a,m);var r=c.angle(d);if(r<b)return null;r<l&&(j=m,l=r)}}return h?JU.P3.new3(NaN,0,0):j},"JM.Atom,~N,JU.V3,JU.V3,~B");c(c$,"setStructureIndexes",
function(){for(var a,b=0,d=-1,c=-1,f=-1,e=0;e<this.ac;e++)if(null!=this.at[e]){if((c=this.at[e].mi)!=f)b=0,f=c,d=-1;if((a=this.at[e].group.getStrucNo())!=d&&0!=a)this.at[e].group.setStrucNo(++b),d=b}});c(c$,"getModelInfoAsString",function(){var a=(new JU.SB).append('<models count="');a.appendI(this.mc).append('" modelSetHasVibrationVectors="').append(this.modelSetHasVibrationVectors()+'">\n<properties>');if(null!=this.modelSetProperties){for(var b=this.modelSetProperties.propertyNames();b.hasMoreElements();){var d=
b.nextElement();a.append('\n <property name="').append(d).append('" value=').append(JU.PT.esc(this.modelSetProperties.getProperty(d))).append(" />")}a.append("\n</properties>")}for(b=0;b<this.mc;++b)a.append('\n<model index="').appendI(b).append('" n="').append(this.getModelNumberDotted(b)).append('" id=').append(JU.PT.esc(""+this.getInfo(b,"modelID"))),d=this.vwr.getJDXBaseModelIndex(b),d!=b&&a.append(" baseModelId=").append(JU.PT.esc(this.getInfo(d,"jdxModelID"))),a.append(" name=").append(JU.PT.esc(this.getModelName(b))).append(" title=").append(JU.PT.esc(this.getModelTitle(b))).append(' hasVibrationVectors="').appendB(this.vwr.modelHasVibrationVectors(b)).append('" />');
a.append("\n</models>");return a.toString()});c(c$,"getSymmetryInfoAsString",function(){for(var a=(new JU.SB).append("Symmetry Information:"),b=0;b<this.mc;++b){a.append("\nmodel #").append(this.getModelNumberDotted(b)).append("; name=").append(this.getModelName(b)).append("\n");var d=this.getUnitCell(b);a.append(null==d?"no symmetry information":d.getSymmetryInfoStr())}return a.toString()});c(c$,"createModels",function(a){a=this.mc+a;var b=JU.AU.arrayCopyObject(this.am,a);this.validateBspf(!1);this.modelNumbers=
JU.AU.arrayCopyI(this.modelNumbers,a);this.modelFileNumbers=JU.AU.arrayCopyI(this.modelFileNumbers,a);this.modelNumbersForAtomLabel=JU.AU.arrayCopyS(this.modelNumbersForAtomLabel,a);this.modelNames=JU.AU.arrayCopyS(this.modelNames,a);this.frameTitles=JU.AU.arrayCopyS(this.frameTitles,a);for(var d=w(this.modelFileNumbers[this.mc-1]/1E6)+1,c=this.mc,f=0;c<a;c++)this.modelNumbers[c]=c+this.mc,this.modelFileNumbers[c]=1E6*d+ ++f,this.modelNumbersForAtomLabel[c]=this.modelNames[c]=d+"."+f;this.thisStateModel=
-1;d=this.getInfoM("group3Lists");null!=d&&(c=this.getInfoM("group3Counts"),d=JU.AU.arrayCopyS(d,a),c=JU.AU.arrayCopyII(c,a),this.msInfo.put("group3Lists",d),this.msInfo.put("group3Counts",c));this.unitCells=JU.AU.arrayCopyObject(this.unitCells,a);for(c=this.mc;c<a;c++)b[c]=(new JM.Model).set(this,c,-1,null,null,null),b[c].loadState=" model create #"+c+";";this.am=b;this.mc=a},"~N");c(c$,"deleteAtoms",function(a){if(null!=a){for(var b=new JU.BS,d=a.nextSetBit(0);0<=d&&d<this.ac;d=a.nextSetBit(d+1))this.at[d].$delete(b);
for(d=0;d<this.mc;d++){var c=this.am[d];c.resetDSSR(!1);c.bsAtomsDeleted.or(a);c.bsAtomsDeleted.and(c.bsAtoms);a=JU.BSUtil.andNot(c.bsAtoms,c.bsAtomsDeleted);c.firstAtomIndex=a.nextSetBit(0);c.act=a.cardinality();c.isOrderly=c.act==c.bsAtoms.length()}this.deleteBonds(b,!1);this.validateBspf(!1)}},"JU.BS");c(c$,"clearDB",function(a){this.getModelAuxiliaryInfo(this.at[a].mi).remove("dbName")},"~N");c(c$,"adjustAtomArrays",function(a,b,d){this.ac=d;for(var c=b;c<d;c++){this.at[c]=this.at[a[c]];this.at[c].i=
c;var f=this.am[this.at[c].mi];f.firstAtomIndex==a[c]&&(f.firstAtomIndex=c);f.bsAtoms.set(c)}if(null!=this.vibrations)for(c=b;c<d;c++)this.vibrations[c]=this.vibrations[a[c]];if(null!=this.atomTensorList)for(c=b;c<d;c++)if(f=this.atomTensorList[c]=this.atomTensorList[a[c]],null!=f)for(var e=f.length;0<=--e;){var h=f[e];null!=h&&(h.atomIndex1=c)}if(null!=this.atomNames)for(c=b;c<d;c++)this.atomNames[c]=this.atomNames[a[c]];if(null!=this.atomTypes)for(c=b;c<d;c++)this.atomTypes[c]=this.atomTypes[a[c]];
if(null!=this.atomResnos)for(c=b;c<d;c++)this.atomResnos[c]=this.atomResnos[a[c]];if(null!=this.atomSerials)for(c=b;c<d;c++)this.atomSerials[c]=this.atomSerials[a[c]];if(null!=this.atomSeqIDs)for(c=b;c<d;c++)this.atomSeqIDs[c]=this.atomSeqIDs[a[c]];if(null!=this.bfactor100s)for(c=b;c<d;c++)this.bfactor100s[c]=this.bfactor100s[a[c]];if(null!=this.occupancies)for(c=b;c<d;c++)this.occupancies[c]=this.occupancies[a[c]];if(null!=this.partialCharges)for(c=b;c<d;c++)this.partialCharges[c]=this.partialCharges[a[c]]},
"~A,~N,~N");c(c$,"growAtomArrays",function(a){this.at=JU.AU.arrayCopyObject(this.at,a);null!=this.vibrations&&(this.vibrations=JU.AU.arrayCopyObject(this.vibrations,a));null!=this.occupancies&&(this.occupancies=JU.AU.arrayCopyF(this.occupancies,a));null!=this.bfactor100s&&(this.bfactor100s=JU.AU.arrayCopyShort(this.bfactor100s,a));null!=this.partialCharges&&(this.partialCharges=JU.AU.arrayCopyF(this.partialCharges,a));null!=this.atomTensorList&&(this.atomTensorList=JU.AU.arrayCopyObject(this.atomTensorList,
a));null!=this.atomNames&&(this.atomNames=JU.AU.arrayCopyS(this.atomNames,a));null!=this.atomTypes&&(this.atomTypes=JU.AU.arrayCopyS(this.atomTypes,a));null!=this.atomResnos&&(this.atomResnos=JU.AU.arrayCopyI(this.atomResnos,a));null!=this.atomSerials&&(this.atomSerials=JU.AU.arrayCopyI(this.atomSerials,a));null!=this.atomSeqIDs&&(this.atomSeqIDs=JU.AU.arrayCopyI(this.atomSeqIDs,a))},"~N");c(c$,"addAtom",function(a,b,d,c,f,e,h,j,l,z,m,r,n,p,q,s,t,u,v,w){j=(new JM.Atom).setAtom(a,this.ac,l,z,v,j,d,
r,t);this.am[a].act++;this.am[a].bsAtoms.set(this.ac);JU.Elements.isElement(d,1)&&this.am[a].hydrogenCount++;this.ac>=this.at.length&&this.growAtomArrays(this.ac+100);this.at[this.ac]=j;this.setBFactor(this.ac,q,!1);this.setOccupancy(this.ac,p,!1);this.setPartialCharge(this.ac,n,!1);null!=s&&this.setAtomTensors(this.ac,s);j.group=b;j.colixAtom=this.vwr.cm.getColixAtomPalette(j,J.c.PAL.CPK.id);null!=c&&(null!=f&&(null==this.atomTypes&&(this.atomTypes=Array(this.at.length)),this.atomTypes[this.ac]=
f),j.atomID=u,0==u&&(null==this.atomNames&&(this.atomNames=Array(this.at.length)),this.atomNames[this.ac]=c.intern()));-2147483648!=e&&(null==this.atomSerials&&(this.atomSerials=B(this.at.length,0)),this.atomSerials[this.ac]=e);0!=h&&(null==this.atomSeqIDs&&(this.atomSeqIDs=B(this.at.length,0)),this.atomSeqIDs[this.ac]=h);null!=m&&this.setVibrationVector(this.ac,m);Float.isNaN(w)||this.setBondingRadius(this.ac,w);this.ac++;return j},"~N,JM.Group,~N,~S,~S,~N,~N,~N,JU.P3,~N,JU.V3,~N,~N,~N,~N,JU.Lst,~B,~N,JU.BS,~N");
c(c$,"getInlineData",function(a){var b=null;if(0<=a)b=this.am[a].loadScript;else for(a=this.mc;0<=--a&&!(0<(b=this.am[a].loadScript).length()););a=b.lastIndexOf('data "');if(0>a)return b=JU.PT.getQuotedStringAt(b.toString(),0),JS.ScriptCompiler.unescapeString(b,0,b.length);a=b.indexOf2('"',a+7);var d=b.lastIndexOf('end "');return d<a||0>a?null:b.substring2(a+2,d)},"~N");c(c$,"isAtomPDB",function(a){return 0<=a&&this.am[this.at[a].mi].isBioModel},"~N");c(c$,"isAtomInLastModel",function(a){return 0<=
a&&this.at[a].mi==this.mc-1},"~N");c(c$,"haveModelKit",function(){for(var a=0;a<this.mc;a++)if(this.am[a].isModelKit)return!0;return!1});c(c$,"getModelKitStateBitset",function(a,b){for(var d=JU.BSUtil.copy(b),c=0;c<this.mc;c++)this.am[c].isModelKit||d.andNot(this.am[c].bsAtoms);return JU.BSUtil.deleteBits(a,d)},"JU.BS,JU.BS");c(c$,"setAtomNamesAndNumbers",function(a,b,d){0>b&&(a=this.am[this.at[a].mi].firstAtomIndex);null==this.atomSerials&&(this.atomSerials=B(this.ac,0));null==this.atomNames&&(this.atomNames=
Array(this.ac));for(var c=this.isXYZ&&this.vwr.getBoolean(603979978),f=2147483647,e=1;a<this.ac;++a){var h=this.at[a];if(null!=h){h.mi!=f&&(f=h.mi,e=c?0:1);var j=this.atomSerials[a];if(a>=-b){if(0==j||0>b)this.atomSerials[a]=a<b?d.atomSerials[a]:e;if(null==this.atomNames[a]||0>b)this.atomNames[a]=(h.getElementSymbol()+this.atomSerials[a]).intern()}else j>e&&(e=j);(!this.am[f].isModelKit||0<h.getElementNumber()&&!h.isDeleted())&&e++}}},"~N,~N,JM.AtomCollection");c(c$,"setUnitCellOffset",function(a,
b,d){null!=a&&(null==b?a.setOffset(d):a.setOffsetPt(b))},"J.api.SymmetryInterface,JU.T3,~N");c(c$,"connect",function(a){this.resetMolecules();for(var b=new JU.BS,d=0;d<a.length;d++){var c=a[d];if(!(null==c||2>c.length)){var f=A(c[0]),e=0>f;e&&(f=-1-f);var h=A(c[1]);if(!(0>h||f>=this.ac||h>=this.ac)){var j=2<c.length?A(c[2]):1;0>j&&(j&=65535);var l=3<c.length?$(1E3*a[d][3]):this.getDefaultMadFromOrder(j);0==j||0==l&&32768!=j&&!JU.Edge.isOrderH(j)?(c=this.at[f].getBond(this.at[h]),null!=c&&b.set(c.index)):
this.bondAtoms(this.at[f],this.at[h],j,l,null,4<c.length?c[4]:0,e,!0)}}}0<=b.nextSetBit(0)&&this.deleteBonds(b,!1)},"~A");c(c$,"setFrameDelayMs",function(a,b){for(var d=b.nextSetBit(0);0<=d;d=b.nextSetBit(d+1))this.am[this.am[d].trajectoryBaseIndex].frameDelay=a},"~N,JU.BS");c(c$,"getFrameDelayMs",function(a){return a<this.am.length&&0<=a?this.am[this.am[a].trajectoryBaseIndex].frameDelay:0},"~N");c(c$,"getModelIndexFromId",function(a){var b=0<=a.indexOf("#"),d=a.toLowerCase().endsWith(".basemodel");
d&&(a=a.substring(0,a.length-10));for(var c=-1,f=null,e=0;e<this.mc;e++){var h=this.getInfo(e,"modelID"),j=a.startsWith("~")?"~"+this.getModelNumberDotted(e):null;if(!(null==j&&null==h&&null==(h=this.getModelTitle(e)))){b&&(f=this.getModelFileName(e),f.endsWith("#molfile")?h=f:(f+="#",h=f+h));if(a.equalsIgnoreCase(h)||a.equalsIgnoreCase(j))return d?this.vwr.getJDXBaseModelIndex(e):e;null!=f&&a.startsWith(f)&&(c=-2)}}return null==f&&!b?-2:c},"~S");c(c$,"getAuxiliaryInfo",function(a){var b=this.msInfo;
null==b&&(b=new java.util.Hashtable);if(null!=a||!b.containsKey("models")){for(var d=new JU.Lst,c=0;c<this.mc;++c)if(null==a||a.get(c)){var f=this.getModelAuxiliaryInfo(c);f.put("modelIndex",Integer.$valueOf(c));d.addLast(f)}b.put("models",d)}return b},"JU.BS");c(c$,"getDihedralMap",function(a){for(var b=new JU.Lst,d=a.length,c=null,f=null,e=null,h=null,j=d-1;0<=--j;)for(var l=d;--l>j;)if(c=this.at[a[j]],f=this.at[a[l]],c.isBonded(f))for(var n=d;0<=--n;)if(n!=j&&n!=l&&(e=this.at[a[n]]).isBonded(c))for(var m=
d;0<=--m;)if(m!=j&&m!=l&&m!=n&&(h=this.at[a[m]]).isBonded(f)){var r=B(4,0);r[0]=e.i;r[1]=c.i;r[2]=f.i;r[3]=h.i;b.addLast(r)}d=b.size();a=JU.AU.newInt2(d);for(j=d;0<=--j;)a[d-j-1]=b.get(j);return a},"~A");c(c$,"setModulation",function(a,b,d,c){if(null==this.bsModulated)if(b)this.bsModulated=new JU.BS;else if(null==a)return;null==a&&(a=this.getModelAtomBitSetIncludingDeleted(-1,!1));for(var f=this.vwr.getFloat(1275072532),e=!1,h=a.nextSetBit(0);0<=h;h=a.nextSetBit(h+1)){var j=this.getModulation(h);
null!=j&&(j.setModTQ(this.at[h],b,d,c,f),null!=this.bsModulated&&this.bsModulated.setBitTo(h,b),e=!0)}e||(this.bsModulated=null)},"JU.BS,~B,JU.P3,~B");c(c$,"getBoundBoxOrientation",function(a,b){var d=0,c=0,f=0,e=null,h=null,j=b.nextSetBit(0),l=0;if(0<=j){c=null==this.vOrientations?0:this.vOrientations.length;if(0==c){e=Array(3375);c=0;l=new JU.P4;for(d=-7;7>=d;d++)for(f=-7;7>=f;f++)for(var n=0;14>=n;n++,c++)1<(e[c]=JU.V3.new3(d/7,f/7,n/14)).length()&&--c;this.vOrientations=Array(c);for(d=c;0<=--d;)n=
Math.sqrt(1-e[d].lengthSquared()),Float.isNaN(n)&&(n=0),l.set4(e[d].x,e[d].y,e[d].z,n),this.vOrientations[d]=JU.Quat.newP4(l)}var n=new JU.P3,l=3.4028235E38,m=null,r=new JU.BoxInfo;r.setMargin(1312817669==a?0:0.1);for(d=0;d<c;d++){e=this.vOrientations[d];r.reset();for(f=j;0<=f;f=b.nextSetBit(f+1))r.addBoundBoxPoint(e.transform2(this.at[f],n));switch(a){default:case 1312817669:case 1073741864:case 1814695966:f=(r.bbCorner1.x-r.bbCorner0.x)*(r.bbCorner1.y-r.bbCorner0.y)*(r.bbCorner1.z-r.bbCorner0.z);
break;case 1111492629:f=r.bbCorner1.x-r.bbCorner0.x;break;case 1111492630:f=r.bbCorner1.y-r.bbCorner0.y;break;case 1111492631:f=r.bbCorner1.z-r.bbCorner0.z}f<l&&(h=e,m=r,r=new JU.BoxInfo,r.setMargin(0.1),l=f)}switch(a){default:return h;case 1814695966:j=m.getBoundBoxVertices();j=u(-1,[j[0],j[4],j[2],j[1]]);h=h.inv();for(d=0;4>d;d++)h.transform2(j[d],j[d]),0<d&&j[d].sub(j[0]);return j;case 1312817669:case 1073741864:e=JU.Quat.newQ(h),d=m.bbCorner1.x-m.bbCorner0.x,c=m.bbCorner1.y-m.bbCorner0.y,f=m.bbCorner1.z-
m.bbCorner0.z,d<c&&(n.set(0,0,1),e=JU.Quat.newVA(n,90).mulQ(e),h=d,d=c,c=h),c<f&&(f>d&&(n.set(0,1,0),e=JU.Quat.newVA(n,90).mulQ(e),h=d,d=f,f=h),n.set(1,0,0),e=JU.Quat.newVA(n,90).mulQ(e),h=c,c=f,f=h)}}return 1312817669==a?l+"\t{"+d+" "+c+" "+f+"}\t"+b:1814695966==a?null:null==e||0==e.getTheta()?new JU.Quat:e},"~N,JU.BS");c(c$,"getUnitCellForAtom",function(a){if(0>a||a>this.ac)return null;if(null!=this.bsModulated){var b=this.getModulation(a),b=null==b?null:b.getSubSystemUnitCell();if(null!=b)return b}return this.getUnitCell(this.at[a].mi)},
"~N");c(c$,"clearCache",function(){for(var a=this.mc;0<=--a;)this.am[a].resetDSSR(!1)});c(c$,"getSymMatrices",function(a){var b=this.getModelSymmetryCount(a);if(0==b)return null;var d=Array(b),c=this.am[a].biosymmetry;null==c&&(c=this.getUnitCell(a));for(a=b;0<=--a;)d[a]=c.getSpaceGroupOperation(a);return d},"~N");c(c$,"getBsBranches",function(a){for(var b=w(a.length/6),d=Array(b),c=new java.util.Hashtable,f=0,e=0;f<b;f++,e+=6)if(!(1>Math.abs(a[e+5]-a[e+4]))){var h=A(a[e+1]),j=A(a[e+2]),l=""+h+"_"+
j;if(!c.containsKey(l)){c.put(l,Boolean.TRUE);for(var l=this.vwr.getBranchBitSet(j,h,!0),n=this.at[h].bonds,h=this.at[h],m=0;m<n.length;m++){var r=n[m];if(r.isCovalent()&&(r=r.getOtherAtom(h).i,r!=j&&l.get(r))){l=null;break}}d[f]=l}}return d},"~A");c(c$,"recalculatePositionDependentQuantities",function(a,b){null!=this.vwr.shm.getShape(21)&&this.vwr.shm.getShapePropertyData(21,"move",u(-1,[a,b]));this.haveStraightness&&this.calculateStraightnessAll();this.recalculateLeadMidpointsAndWingVectors(-1);
for(var d=this.getModelBS(a,!1),c=d.nextSetBit(0);0<=c;c=d.nextSetBit(c+1))if(this.sm.notifyAtomPositionsChanged(c,a,b),null!=b){var f=this.am[c];f.isContainedIn(a)&&(null==f.mat4&&(f.mat4=JU.M4.newM4(null)),f.mat4.mul2(b,f.mat4))}},"JU.BS,JU.M4");c(c$,"moveAtoms",function(a,b,d,c,f,e,h,j){if(null!=a){for(b=f.nextSetBit(0);0<=b;b=f.nextSetBit(b+1))a.rotTrans(this.at[b]),this.taintAtom(b,2);this.mat4.setM4(a);c=null}else if(!j){null==b?this.matTemp.setM3(d):(this.ptTemp.set(0,0,0),this.matInv.setM3(d),
this.matInv.invert(),this.matTemp.mul2(b,d),this.matTemp.mul2(this.matInv,this.matTemp));h?(this.vTemp.setT(e),this.mat4.setIdentity(),this.mat4.setTranslation(this.vTemp),this.mat4t.setToM3(this.matTemp),this.mat4.mul(this.mat4t),this.mat4t.setIdentity(),this.vTemp.scale(-1),this.mat4t.setTranslation(this.vTemp),this.mat4.mul(this.mat4t)):this.mat4.setToM3(this.matTemp);for(b=f.nextSetBit(0);0<=b;b=f.nextSetBit(b+1))h?this.mat4.rotTrans(this.at[b]):(this.ptTemp.add(this.at[b]),this.mat4.rotTrans(this.at[b]),
this.ptTemp.sub(this.at[b])),this.taintAtom(b,2);h||(this.ptTemp.scale(1/f.cardinality()),null==c&&(c=new JU.V3),c.add(this.ptTemp))}if(null!=c){for(b=f.nextSetBit(0);0<=b;b=f.nextSetBit(b+1))this.at[b].add(c),this.taintAtom(b,2);j||(this.mat4t.setIdentity(),this.mat4t.setTranslation(c),this.mat4.mul2(this.mat4t,this.mat4))}this.recalculatePositionDependentQuantities(f,this.mat4)},"JU.M4,JU.M3,JU.M3,JU.V3,JU.BS,JU.P3,~B,~B");c(c$,"setDihedrals",function(a,b,d){var c=w(a.length/6);1<d&&(d=1);for(var f=
0,e=0;f<c;f++,e+=6){var h=b[f];if(!(null==h||h.isEmpty())){var j=this.at[A(a[e+1])],l=JU.V3.newVsub(this.at[A(a[e+2])],j),l=JU.A4.newVA(l,-((a[e+5]-a[e+4])*d)/57.29577951308232);this.matTemp.setAA(l);this.ptTemp.setT(j);for(j=h.nextSetBit(0);0<=j;j=h.nextSetBit(j+1))this.at[j].sub(this.ptTemp),this.matTemp.rotate(this.at[j]),this.at[j].add(this.ptTemp),this.taintAtom(j,2)}}},"~A,~A,~N");c(c$,"setAtomCoordsRelative",function(a,b){this.setAtomsCoordRelative(b,a.x,a.y,a.z);this.mat4.setIdentity();this.vTemp.setT(a);
this.mat4.setTranslation(this.vTemp);this.recalculatePositionDependentQuantities(b,this.mat4)},"JU.T3,JU.BS");c(c$,"setAtomCoords",function(a,b,d){this.setAtomCoord2(a,b,d);switch(b){case 1111492626:case 1111492627:case 1111492628:case 1145047055:break;default:this.recalculatePositionDependentQuantities(a,null)}},"JU.BS,~N,~O");c(c$,"invertSelected",function(a,b,d,c){this.resetChirality();if(null!=a)for(var f=c.nextSetBit(0);0<=f;f=c.nextSetBit(f+1)){var e=2*(a.x-this.at[f].x);d=2*(a.y-this.at[f].y);
var h=2*(a.z-this.at[f].z);this.setAtomCoordRelative(f,e,d,h)}else if(null!=b){a=JU.V3.new3(b.x,b.y,b.z);a.normalize();for(var j=Math.sqrt(b.x*b.x+b.y*b.y+b.z*b.z),f=c.nextSetBit(0);0<=f;f=c.nextSetBit(f+1))h=2*-JU.Measure.distanceToPlaneD(b,j,this.at[f]),e=a.x*h,d=a.y*h,h*=a.z,this.setAtomCoordRelative(f,e,d,h)}else if(0<=d&&(b=this.at[d],a=b.bonds,null!=a)){e=new JU.BS;h=new JU.Lst;j=this.vwr.getModelUndeletedAtomsBitSet(b.mi);for(f=0;f<a.length;f++){var l=a[f].getOtherAtom(b);c.get(l.i)?e.or(JU.JmolMolecule.getBranchBitSet(this.at,
l.i,j,null,d,!0,!0)):h.addLast(l)}0!=h.size()&&(a=JU.Measure.getCenterAndPoints(h)[0],c=JU.V3.newVsub(b,a),c=JU.Quat.newVA(c,180),this.moveAtoms(null,null,c.getMatrix(),null,e,b,!0,!1))}},"JU.P3,JU.P4,~N,JU.BS");c(c$,"getCellWeights",function(a){var b=null,d=a.nextSetBit(0),c=-1;if(0<=d&&null!=this.getUnitCell(c=this.at[d].mi)){var f=new JU.P3;this.getModelAtomBitSetIncludingDeleted(c,!0).and(a);b=K(a.cardinality(),0);for(c=0;0<=d;d=a.nextSetBit(d+1))b[c++]=JU.SimpleUnitCell.getCellWeight(this.at[d].getFractionalUnitCoordPt(!0,
!1,f))}return b},"JU.BS");c(c$,"getAtomGroupQuaternions",function(a,b,d){var c=0,f=new JU.Lst;a=JU.BSUtil.copy(a);for(var e=new JU.BS,h=a.nextSetBit(0);0<=h&&c<b;h=a.nextSetBit(h+1)){var j=this.at[h].group;j.setAtomBits(e);a.andNot(e);var l=j.getQuaternion(d);if(null==l&&(this.am[this.at[h].mi].isBioModel||(l=j.getQuaternionFrame(this.at)),null==l))continue;c++;f.addLast(l)}return f.toArray(Array(f.size()))},"JU.BS,~N,~S");c(c$,"getConformation",function(a,b,d,c){var f=new JU.BS;if(0<=b)for(var e=
this.mc;0<=--e;)if(!(e!=a&&0<=a)){var h=this.am[e],j=this.vwr.getModelUndeletedAtomsBitSet(a);null!=c&&j.and(c);if(!(0>j.nextSetBit(0)))if(b>=h.altLocCount)0==b&&f.or(j);else if(!this.am[e].isBioModel||!this.am[e].getConformation(b,d,j,f)){for(var l=this.getAltLocCountInModel(e),h=this.getAltLocListInModel(e),n=new JU.BS;0<=--l;)l!=b&&j.andNot(this.getAtomBitsMDa(1073742355,h.substring(l,l+1),n));0<=j.nextSetBit(0)&&f.or(j)}}return f},"~N,~N,~B,JU.BS");c(c$,"getSequenceBits",function(a,b,d){return this.haveBioModels?
this.bioModelset.getAllSequenceBits(a,b,d):d},"~S,JU.BS,JU.BS");c(c$,"getBioPolymerCountInModel",function(a){return this.haveBioModels?this.bioModelset.getBioPolymerCountInModel(a):0},"~N");c(c$,"getPolymerPointsAndVectors",function(a,b,d,c){this.haveBioModels&&this.bioModelset.getAllPolymerPointsAndVectors(a,b,d,c)},"JU.BS,JU.Lst,~B,~N");c(c$,"recalculateLeadMidpointsAndWingVectors",function(a){this.haveBioModels&&this.bioModelset.recalculatePoints(a)},"~N");c(c$,"calcRasmolHydrogenBonds",function(a,
b,d,c,f,e,h){this.haveBioModels&&this.bioModelset.calcAllRasmolHydrogenBonds(a,b,d,c,f,e,h,2)},"JU.BS,JU.BS,JU.Lst,~B,~N,~B,JU.BS");c(c$,"calculateStraightnessAll",function(){this.haveBioModels&&!this.haveStraightness&&this.bioModelset.calculateStraightnessAll()});c(c$,"calculateStruts",function(a,b){return this.haveBioModels?this.bioModelset.calculateStruts(a,b):0},"JU.BS,JU.BS");c(c$,"getGroupsWithin",function(a,b){return this.haveBioModels?this.bioModelset.getGroupsWithinAll(a,b):new JU.BS},"~N,JU.BS");
c(c$,"getProteinStructureState",function(a,b){return this.haveBioModels?this.bioModelset.getFullProteinStructureState(a,b):""},"JU.BS,~N");c(c$,"calculateStructures",function(a,b,d,c,f,e){return this.haveBioModels?this.bioModelset.calculateAllStuctures(a,b,d,c,f,e):""},"JU.BS,~B,~B,~B,~B,~N");c(c$,"calculateStructuresAllExcept",function(a,b,d,c,f,e,h){this.freezeModels();return this.haveBioModels?this.bioModelset.calculateAllStructuresExcept(a,b,d,c,f,e,h):""},"JU.BS,~B,~B,~B,~B,~B,~N");c(c$,"recalculatePolymers",
function(a){this.bioModelset.recalculateAllPolymers(a,this.getGroups())},"JU.BS");c(c$,"calculatePolymers",function(a,b,d,c){null!=this.bioModelset&&this.bioModelset.calculateAllPolymers(a,b,d,c)},"~A,~N,~N,JU.BS");c(c$,"calcSelectedMonomersCount",function(){this.haveBioModels&&this.bioModelset.calcSelectedMonomersCount()});c(c$,"setProteinType",function(a,b){this.haveBioModels&&this.bioModelset.setAllProteinType(a,b)},"JU.BS,J.c.STR");c(c$,"setStructureList",function(a){this.haveBioModels&&this.bioModelset.setAllStructureList(a)},
"java.util.Map");c(c$,"setConformation",function(a){this.haveBioModels&&this.bioModelset.setAllConformation(a);return a},"JU.BS");c(c$,"getHeteroList",function(a){a=this.haveBioModels?this.bioModelset.getAllHeteroList(a):null;return null==a?this.getInfoM("hetNames"):a},"~N");c(c$,"getUnitCellPointsWithin",function(a,b,d,c){var f=new JU.Lst,e=null,h=null;c&&(e=new java.util.Hashtable,h=new JU.Lst,e.put("atoms",h),e.put("points",f));var j=null==b?-1:b.nextSetBit(0);b=this.vwr.getModelUndeletedAtomsBitSet(0>
j?this.vwr.am.cmi:this.at[j].mi);0>j&&(j=b.nextSetBit(0));if(0<=j){var l=this.getUnitCellForAtom(j);if(null!=l){b=l.getIterator(this.vwr,this.at[j],this.at,b,a);for(null!=d&&b.setCenter(d,a);b.hasNext();)j=b.next(),d=b.getPosition(),f.addLast(d),c&&h.addLast(Integer.$valueOf(j))}}return c?e:f},"~N,JU.BS,JU.P3,~B");c(c$,"calculateDssrProperty",function(a){if(null!=a){if(null==this.dssrData||this.dssrData.length<this.ac)this.dssrData=K(this.ac,0);for(var b=0;b<this.ac;b++)this.dssrData[b]=NaN;for(b=
this.mc;0<=--b;)this.am[b].isBioModel&&this.am[b].getAtomicDSSRData(this.dssrData,a)}},"~S");c(c$,"getAtomicDSSRData",function(a){return null==this.dssrData||this.dssrData.length<=a?NaN:this.dssrData[a]},"~N");c(c$,"getAtomCIPChiralityCode",function(a){this.haveChirality=!0;var b=this.am[a.mi];b.hasChirality||(this.calculateChiralityForAtoms(b.bsAtoms,!1),b.hasChirality=!0);return a.getCIPChiralityCode()},"JM.Atom");c(c$,"calculateChiralityForAtoms",function(a,b){this.haveChirality=!0;for(var d=a.nextSetBit(0);0<=
d;d=a.nextSetBit(d+1))this.at[d].setCIPChirality(0);J.api.Interface.getSymmetry(this.vwr,"ms").calculateCIPChiralityForAtoms(this.vwr,a);if(!b)return null;for(var c="",d=a.nextSetBit(0);0<=d;d=a.nextSetBit(d+1))c+=this.at[d].getCIPChirality(!1);return c},"JU.BS,~B");E(c$,"hbondMinRasmol",2.5)});s("JM");v(["JU.M3","$.P3"],"JM.Orientation",["JU.PT","JU.Escape"],function(){c$=t(function(){this.rotationMatrix=this.saveName=null;this.rotationRadius=this.zoom=this.yTrans=this.xTrans=0;this.navCenter=this.center=
null;this.cameraY=this.cameraX=this.cameraDepth=this.navDepth=this.yNav=this.xNav=NaN;this.navigationMode=this.windowCenteredFlag=!1;this.vwr=this.pymolView=this.moveToText=null;p(this,arguments)},JM,"Orientation");O(c$,function(){this.rotationMatrix=new JU.M3;this.center=new JU.P3;this.navCenter=new JU.P3});q(c$,function(a,b,d){this.vwr=a;null!=d?(this.pymolView=d,this.moveToText="moveTo -1.0 PyMOL "+JU.Escape.eAF(d)):(a.finalizeTransformParameters(),b?(b=a.ms.getInfoM("defaultOrientationMatrix"),
null==b?this.rotationMatrix.setScale(1):this.rotationMatrix.setM3(b)):a.tm.getRotation(this.rotationMatrix),this.xTrans=a.tm.getTranslationXPercent(),this.yTrans=a.tm.getTranslationYPercent(),this.zoom=a.tm.getZoomSetting(),this.center.setT(a.tm.fixedRotationCenter),this.windowCenteredFlag=a.tm.isWindowCentered(),this.rotationRadius=a.getFloat(570425388),this.navigationMode=a.getBoolean(603979889),this.moveToText=a.tm.getMoveToText(-1,!1),this.navigationMode&&(this.xNav=a.tm.getNavigationOffsetPercent("X"),
this.yNav=a.tm.getNavigationOffsetPercent("Y"),this.navDepth=a.tm.navigationDepthPercent,this.navCenter=JU.P3.newP(a.tm.navigationCenter)),0!=a.tm.camera.z&&(this.cameraDepth=a.tm.getCameraDepth(),this.cameraX=a.tm.camera.x,this.cameraY=a.tm.camera.y))},"JV.Viewer,~B,~A");c(c$,"getMoveToText",function(a){return a?"   "+this.moveToText+"\n  save orientation "+JU.PT.esc(this.saveName.substring(12))+";\n":this.moveToText},"~B");c(c$,"restore",function(a,b){b?(this.vwr.setBooleanProperty("windowCentered",
this.windowCenteredFlag),this.vwr.setBooleanProperty("navigationMode",this.navigationMode),null==this.pymolView?this.vwr.moveTo(this.vwr.eval,a,this.center,null,NaN,this.rotationMatrix,this.zoom,this.xTrans,this.yTrans,this.rotationRadius,this.navCenter,this.xNav,this.yNav,this.navDepth,this.cameraDepth,this.cameraX,this.cameraY):this.vwr.tm.moveToPyMOL(this.vwr.eval,a,this.pymolView)):this.vwr.tm.setRotation(this.rotationMatrix);return!0},"~N,~B")});s("JM");v(null,"JM.StateScript",["JU.SB","JU.BSUtil",
"$.Escape"],function(){c$=t(function(){this.modelIndex=0;this.script2=this.script1=this.bsAtoms2=this.bsAtoms1=this.bsBonds=null;this.inDefinedStateBlock=!1;p(this,arguments)},JM,"StateScript");q(c$,function(a,b,d,c,f,e,h){this.modelIndex=a;this.script1=b;this.bsBonds=JU.BSUtil.copy(d);this.bsAtoms1=JU.BSUtil.copy(c);this.bsAtoms2=JU.BSUtil.copy(f);this.script2=e;this.inDefinedStateBlock=h},"~N,~S,JU.BS,JU.BS,JU.BS,~S,~B");c(c$,"isValid",function(){return null!=this.script1&&0<this.script1.length&&
(null==this.bsBonds||0<=this.bsBonds.nextSetBit(0))&&(null==this.bsAtoms1||0<=this.bsAtoms1.nextSetBit(0))&&(null==this.bsAtoms2||0<=this.bsAtoms2.nextSetBit(0))});j(c$,"toString",function(){if(!this.isValid())return"";var a=JU.SB.newS(this.script1);null!=this.bsBonds&&a.append(" ").append(JU.Escape.eBond(this.bsBonds));null!=this.bsAtoms1&&a.append(" ").append(JU.Escape.eBS(this.bsAtoms1));null!=this.bsAtoms2&&a.append(" ").append(JU.Escape.eBS(this.bsAtoms2));null!=this.script2&&a.append(" ").append(this.script2);
a=a.toString();a.endsWith(";")||(a+=";");return a});c(c$,"isConnect",function(){return 0<=this.script1.indexOf("connect")});c(c$,"deleteAtoms",function(a,b,d){if(a==this.modelIndex)return!1;if(a>this.modelIndex)return!0;JU.BSUtil.deleteBits(this.bsBonds,b);JU.BSUtil.deleteBits(this.bsAtoms1,d);JU.BSUtil.deleteBits(this.bsAtoms2,d);return this.isValid()},"~N,JU.BS,JU.BS");c(c$,"setModelIndex",function(a){this.modelIndex=a},"~N")});s("JM");N(JM,"Structure");s("JM");c$=t(function(){this.id="";this.type=
" ";this.scale=this.tickLabelFormats=this.ticks=null;this.first=0;this.signFactor=1;this.reference=null;p(this,arguments)},JM,"TickInfo");q(c$,function(a){this.ticks=a},"JU.P3");s("JU");v(["JU.P3","$.V3"],"JU.BoxInfo",["JU.Point3fi"],function(){c$=t(function(){this.bbVertices=this.bbVector=this.bbCenter=this.bbCorner1=this.bbCorner0=null;this.isScaleSet=!1;this.margin=0;p(this,arguments)},JU,"BoxInfo");O(c$,function(){this.bbCorner0=new JU.P3;this.bbCorner1=new JU.P3;this.bbCenter=new JU.P3;this.bbVector=
new JU.V3;this.bbVertices=Array(8);for(var a=0;8>a;a++)JU.BoxInfo.unitBboxPoints[a]=JU.P3.new3(-1,-1,-1),JU.BoxInfo.unitBboxPoints[a].scaleAdd2(2,JU.BoxInfo.unitCubePoints[a],JU.BoxInfo.unitBboxPoints[a])});q(c$,function(){for(var a=8;0<=--a;)this.bbVertices[a]=new JU.Point3fi;this.reset()});c(c$,"reset",function(){this.isScaleSet=!1;this.bbCorner0.set(3.4028235E38,3.4028235E38,3.4028235E38);this.bbCorner1.set(-3.4028235E38,-3.4028235E38,-3.4028235E38)});c$.scaleBox=c(c$,"scaleBox",function(a,b){if(!(0==
b||1==b)){for(var d=new JU.P3,c=new JU.V3,f=0;8>f;f++)d.add(a[f]);d.scale(0.125);for(f=0;8>f;f++)c.sub2(a[f],d),c.scale(b),a[f].add2(d,c)}},"~A,~N");c$.getVerticesFromOABC=c(c$,"getVerticesFromOABC",function(a){for(var b=Array(8),d=0;7>=d;d++)b[d]=JU.P3.newP(a[0]),4==(d&4)&&b[d].add(a[1]),2==(d&2)&&b[d].add(a[2]),1==(d&1)&&b[d].add(a[3]);return b},"~A");c$.getCanonicalCopy=c(c$,"getCanonicalCopy",function(a,b){for(var d=Array(8),c=0;8>c;c++)d[JU.BoxInfo.toCanonical[c]]=JU.P3.newP(a[c]);JU.BoxInfo.scaleBox(d,
b);return d},"~A,~N");c$.toOABC=c(c$,"toOABC",function(a,b){var d=JU.P3.newP(a[0]),c=JU.P3.newP(a[4]),f=JU.P3.newP(a[2]),e=JU.P3.newP(a[1]);c.sub(d);f.sub(d);e.sub(d);null!=b&&d.add(b);return u(-1,[d,c,f,e])},"~A,JU.T3");c(c$,"getBoundBoxCenter",function(){this.isScaleSet||this.setBbcage(1);return this.bbCenter});c(c$,"getBoundBoxCornerVector",function(){this.isScaleSet||this.setBbcage(1);return this.bbVector});c(c$,"getBoundBoxPoints",function(a){this.isScaleSet||this.setBbcage(1);return a?u(-1,
[this.bbCenter,JU.P3.newP(this.bbVector),this.bbCorner0,this.bbCorner1]):u(-1,[this.bbCorner0,this.bbCorner1])},"~B");c(c$,"getBoundBoxVertices",function(){this.isScaleSet||this.setBbcage(1);return this.bbVertices});c(c$,"setBoundBoxFromOABC",function(a){for(var b=JU.P3.newP(a[0]),d=new JU.P3,c=0;4>c;c++)d.add(a[c]);this.setBoundBox(b,d,!0,1)},"~A");c(c$,"setBoundBox",function(a,b,d,c){if(null!=a){if(0==c)return;if(d){if(0==a.distance(b))return;this.bbCorner0.set(Math.min(a.x,b.x),Math.min(a.y,b.y),
Math.min(a.z,b.z));this.bbCorner1.set(Math.max(a.x,b.x),Math.max(a.y,b.y),Math.max(a.z,b.z))}else{if(0==b.x||0==b.y&&0==b.z)return;this.bbCorner0.set(a.x-b.x,a.y-b.y,a.z-b.z);this.bbCorner1.set(a.x+b.x,a.y+b.y,a.z+b.z)}}this.setBbcage(c)},"JU.T3,JU.T3,~B,~N");c(c$,"setMargin",function(a){this.margin=a},"~N");c(c$,"addBoundBoxPoint",function(a){this.isScaleSet=!1;JU.BoxInfo.addPoint(a,this.bbCorner0,this.bbCorner1,this.margin)},"JU.T3");c$.addPoint=c(c$,"addPoint",function(a,b,d,c){a.x-c<b.x&&(b.x=
a.x-c);a.x+c>d.x&&(d.x=a.x+c);a.y-c<b.y&&(b.y=a.y-c);a.y+c>d.y&&(d.y=a.y+c);a.z-c<b.z&&(b.z=a.z-c);a.z+c>d.z&&(d.z=a.z+c)},"JU.T3,JU.T3,JU.T3,~N");c$.addPointXYZ=c(c$,"addPointXYZ",function(a,b,d,c,f,e){a-e<c.x&&(c.x=a-e);a+e>f.x&&(f.x=a+e);b-e<c.y&&(c.y=b-e);b+e>f.y&&(f.y=b+e);d-e<c.z&&(c.z=d-e);d+e>f.z&&(f.z=d+e)},"~N,~N,~N,JU.P3,JU.P3,~N");c(c$,"setBbcage",function(a){this.isScaleSet=!0;this.bbCenter.add2(this.bbCorner0,this.bbCorner1);this.bbCenter.scale(0.5);this.bbVector.sub2(this.bbCorner1,
this.bbCenter);0<a?this.bbVector.scale(a):(this.bbVector.x-=a/2,this.bbVector.y-=a/2,this.bbVector.z-=a/2);for(a=8;0<=--a;){var b=this.bbVertices[a];b.setT(JU.BoxInfo.unitBboxPoints[a]);b.x*=this.bbVector.x;b.y*=this.bbVector.y;b.z*=this.bbVector.z;b.add(this.bbCenter)}this.bbCorner0.setT(this.bbVertices[0]);this.bbCorner1.setT(this.bbVertices[7])},"~N");c(c$,"isWithin",function(a){this.isScaleSet||this.setBbcage(1);return a.x>=this.bbCorner0.x&&a.x<=this.bbCorner1.x&&a.y>=this.bbCorner0.y&&a.y<=
this.bbCorner1.y&&a.z>=this.bbCorner0.z&&a.z<=this.bbCorner1.z},"JU.P3");c(c$,"getMaxDim",function(){return 2*this.bbVector.length()});E(c$,"X",4,"Y",2,"Z",1,"XYZ",7,"bbcageTickEdges",ca(-1,"z\x00\x00yx\x00\x00\x00\x00\x00\x00\x00".split("")),"uccageTickEdges",ca(-1,"zyx\x00\x00\x00\x00\x00\x00\x00\x00\x00".split("")),"edges",Q(-1,[0,1,0,2,0,4,1,3,1,5,2,3,2,6,3,7,4,5,4,6,5,7,6,7]));c$.unitCubePoints=c$.prototype.unitCubePoints=u(-1,[JU.P3.new3(0,0,0),JU.P3.new3(0,0,1),JU.P3.new3(0,1,0),JU.P3.new3(0,
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case -13:case -14:return this.ce.userScale.length;case 2:return this.ce.argbsCpk.length;case 3:return JU.ColorEncoder.getRasmolScale().length;case 4:return this.ce.getShapely().length;case 17:return this.ce.getNucleic().length;case 5:return this.ce.getAmino().length;case 12:return this.getPaletteAC().length;default:return 0}},"~N");c(c$,"getArgbFromPalette",function(a,b,d,c){if(Float.isNaN(a))return-8355712;var f=this.getPaletteColorCount(c);switch(c){case -1:return this.isColorIndex&&(b=0,d=this.thisScale.length),
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function(){c$=t(function(){this.vwr=null;this.isMultiTouch=this.haveMultiTouchInput=!1;this.predragBinding=this.rasmolBinding=this.dragBinding=this.pfaatBinding=this.jmolBinding=this.b=null;this.LEFT_DRAGGED=0;this.dragGesture=this.hoverWatcherThread=null;this.apm=1;this.pickingStyleSelect=this.pickingStyle=this.bondPickingMode=0;this.pickingStyleMeasure=5;this.rootPickingStyle=0;this.mouseDragFactor=this.gestureSwipeFactor=1;this.mouseWheelFactor=1.15;this.dragged=this.pressed=this.clicked=this.moved=
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"set pickingStyle DRAG")),JV.ActionManager.newAction(37,"_setMeasure",J.i18n.GT.$("pick an atom to initiate or conclude a measurement")),JV.ActionManager.newAction(38,"_slab",J.i18n.GT.o(J.i18n.GT.$("adjust slab (front plane; requires {0})"),"SLAB ON")),JV.ActionManager.newAction(39,"_slabAndDepth",J.i18n.GT.o(J.i18n.GT.$("move slab/depth window (both planes; requires {0})"),"SLAB ON")),JV.ActionManager.newAction(40,"_slideZoom",J.i18n.GT.$("zoom (along right edge of window)")),JV.ActionManager.newAction(41,
"_spinDrawObjectCCW",J.i18n.GT.o(J.i18n.GT.$("click on two points to spin around axis counterclockwise (requires {0})"),"set picking SPIN")),JV.ActionManager.newAction(42,"_spinDrawObjectCW",J.i18n.GT.o(J.i18n.GT.$("click on two points to spin around axis clockwise (requires {0})"),"set picking SPIN")),JV.ActionManager.newAction(43,"_stopMotion",J.i18n.GT.o(J.i18n.GT.$("stop motion (requires {0})"),"set waitForMoveTo FALSE")),JV.ActionManager.newAction(44,"_swipe",J.i18n.GT.$("spin model (swipe and release button and stop motion simultaneously)")),
JV.ActionManager.newAction(45,"_translate",J.i18n.GT.$("translate")),JV.ActionManager.newAction(46,"_wheelZoom",J.i18n.GT.$("zoom")))});c$.getActionName=c(c$,"getActionName",function(a){return a<JV.ActionManager.actionNames.length?JV.ActionManager.actionNames[a]:null},"~N");c$.getActionFromName=c(c$,"getActionFromName",function(a){for(var b=0;b<JV.ActionManager.actionNames.length;b++)if(JV.ActionManager.actionNames[b].equalsIgnoreCase(a))return b;return-1},"~S");c(c$,"getBindingInfo",function(a){return this.b.getBindingInfo(JV.ActionManager.actionInfo,
JV.ActionManager.actionNames,a)},"~S");c(c$,"setBinding",function(a){this.b=a},"JV.binding.Binding");c(c$,"bnd",function(a,b){for(var d=b.length;0<=--d;)if(this.b.isBound(a,b[d]))return!0;return!1},"~N,~A");c(c$,"isDrawOrLabelAction",function(a){return this.drawMode&&this.bnd(a,[8,9])||this.labelMode&&this.bnd(a,[10])},"~N");c(c$,"getBondPickingMode",function(){return this.bondPickingMode});c$.getPickingModeName=c(c$,"getPickingModeName",function(a){return 0>a||a>=JV.ActionManager.pickingModeNames.length?
"off":JV.ActionManager.pickingModeNames[a]},"~N");c$.getPickingMode=c(c$,"getPickingMode",function(a){for(var b=JV.ActionManager.pickingModeNames.length;0<=--b;)if(a.equalsIgnoreCase(JV.ActionManager.pickingModeNames[b]))return b;return-1},"~S");c$.getPickingStyleName=c(c$,"getPickingStyleName",function(a){return 0>a||a>=JV.ActionManager.pickingStyleNames.length?"toggle":JV.ActionManager.pickingStyleNames[a]},"~N");c$.getPickingStyleIndex=c(c$,"getPickingStyleIndex",function(a){for(var b=JV.ActionManager.pickingStyleNames.length;0<=
--b;)if(a.equalsIgnoreCase(JV.ActionManager.pickingStyleNames[b]))return b;return-1},"~S");c(c$,"getAtomPickingMode",function(){return this.apm});c(c$,"setPickingMode",function(a){var b=!1;switch(a){case -1:b=!0;this.bondPickingMode=35;a=1;this.vwr.setStringProperty("pickingStyle","toggle");this.vwr.setBooleanProperty("bondPicking",!1);break;case 35:case 34:case 33:case 8:this.vwr.setBooleanProperty("bondPicking",!0);this.bondPickingMode=a;this.resetMeasurement();return}b=(new Boolean(b|this.apm!=
a)).valueOf();this.apm=a;b&&this.resetMeasurement()},"~N");c(c$,"getPickingState",function(){var a=";set modelkitMode "+this.vwr.getBoolean(603983903)+";set picking "+JV.ActionManager.getPickingModeName(this.apm);32==this.apm&&(a+="_"+this.vwr.getModelkitProperty("atomType"));a+=";";0!=this.bondPickingMode&&(a+="set picking "+JV.ActionManager.getPickingModeName(this.bondPickingMode));33==this.bondPickingMode&&(a+="_"+this.vwr.getModelkitProperty("bondType"));return a+";"});c(c$,"getPickingStyle",
function(){return this.pickingStyle});c(c$,"setPickingStyle",function(a){this.pickingStyle=a;4<=a?(this.pickingStyleMeasure=a,this.resetMeasurement()):(3>a&&(this.rootPickingStyle=a),this.pickingStyleSelect=a);this.rubberbandSelectionMode=!1;switch(this.pickingStyleSelect){case 2:this.b.name.equals("extendedSelect")||this.setBinding(null==this.pfaatBinding?this.pfaatBinding=JV.binding.Binding.newBinding(this.vwr,"Pfaat"):this.pfaatBinding);break;case 3:this.b.name.equals("drag")||this.setBinding(null==
this.dragBinding?this.dragBinding=JV.binding.Binding.newBinding(this.vwr,"Drag"):this.dragBinding);this.rubberbandSelectionMode=!0;break;case 1:this.b.name.equals("selectOrToggle")||this.setBinding(null==this.rasmolBinding?this.rasmolBinding=JV.binding.Binding.newBinding(this.vwr,"Rasmol"):this.rasmolBinding);break;default:this.b!==this.jmolBinding&&this.setBinding(this.jmolBinding)}this.b.name.equals("drag")||(this.predragBinding=this.b)},"~N");c(c$,"setGestureSwipeFactor",function(a){this.gestureSwipeFactor=
a},"~N");c(c$,"setMouseDragFactor",function(a){this.mouseDragFactor=a},"~N");c(c$,"setMouseWheelFactor",function(a){this.mouseWheelFactor=a},"~N");c(c$,"isDraggedIsShiftDown",function(){return 0!=(this.dragged.modifiers&1)});c(c$,"setCurrent",function(a,b,d,c){this.vwr.hoverOff();this.current.set(a,b,d,c)},"~N,~N,~N,~N");c(c$,"getCurrentX",function(){return this.current.x});c(c$,"getCurrentY",function(){return this.current.y});c(c$,"setMouseMode",function(){this.drawMode=this.labelMode=!1;this.dragSelectedMode=
this.vwr.getDragSelected();this.measuresEnabled=!this.dragSelectedMode;if(!this.dragSelectedMode)switch(this.apm){default:return;case 32:this.measuresEnabled=!this.vwr.getModelkit(!1).isPickAtomAssignCharge();return;case 4:this.drawMode=!0;this.measuresEnabled=!1;break;case 2:this.labelMode=!0;this.measuresEnabled=!1;break;case 9:this.measuresEnabled=!1;break;case 19:case 22:case 20:case 21:this.measuresEnabled=!1;return}this.exitMeasurementMode(null)});c(c$,"clearMouseInfo",function(){this.pressedCount=
this.clickedCount=0;this.dragGesture.setAction(0,0);this.exitMeasurementMode(null)});c(c$,"setDragAtomIndex",function(a){this.dragAtomIndex=a;this.setAtomsPicked(JU.BSUtil.newAndSetBit(a),"Label picked for atomIndex = "+a)},"~N");c(c$,"isMTClient",function(){return this.isMultiTouchClient});c(c$,"isMTServer",function(){return this.isMultiTouchServer});c(c$,"dispose",function(){this.clear()});c(c$,"clear",function(){this.startHoverWatcher(!1);null!=this.predragBinding&&(this.b=this.predragBinding);
this.vwr.setPickingMode(null,1);this.vwr.setPickingStyle(null,this.rootPickingStyle);this.isAltKeyReleased=!0});c(c$,"startHoverWatcher",function(a){if(!this.vwr.isPreviewOnly)try{a?null==this.hoverWatcherThread&&(this.current.time=-1,this.hoverWatcherThread=new J.thread.HoverWatcherThread(this,this.current,this.moved,this.vwr)):null!=this.hoverWatcherThread&&(this.current.time=-1,this.hoverWatcherThread.interrupt(),this.hoverWatcherThread=null)}catch(b){if(!H(b,Exception))throw b;}},"~B");c(c$,"setModeMouse",
function(a){-1==a&&this.startHoverWatcher(!1)},"~N");j(c$,"keyPressed",function(a,b){if(this.keyProcessing)return!1;this.keyProcessing=!0;switch(a){case 18:this.dragSelectedMode&&this.isAltKeyReleased&&this.vwr.moveSelected(-2147483648,0,-2147483648,-2147483648,-2147483648,null,!1,!1,b);this.isAltKeyReleased=!1;this.moved.modifiers|=8;break;case 16:this.dragged.modifiers|=1;this.moved.modifiers|=1;break;case 17:this.moved.modifiers|=2;break;case 27:this.vwr.hoverOff();this.exitMeasurementMode("escape");
break;default:this.vwr.hoverOff()}var d=8464|this.moved.modifiers;!this.labelMode&&!this.b.isUserAction(d)&&this.checkMotionRotateZoom(d,this.current.x,0,0,!1);if(this.vwr.getBoolean(603979889))switch(a){case 38:case 40:case 37:case 39:case 32:case 46:this.vwr.navigate(a,b)}this.keyProcessing=!1;return!0},"~N,~N");j(c$,"keyTyped",function(){return!1},"~N,~N");j(c$,"keyReleased",function(a){switch(a){case 18:this.moved.modifiers&=-9;this.dragSelectedMode&&this.vwr.moveSelected(2147483647,0,-2147483648,
-2147483648,-2147483648,null,!1,!1,this.moved.modifiers);this.isAltKeyReleased=!0;break;case 16:this.moved.modifiers&=-2;break;case 17:this.moved.modifiers&=-3}0==this.moved.modifiers&&this.vwr.setCursor(0);if(this.vwr.getBoolean(603979889))switch(a){case 38:case 40:case 37:case 39:this.vwr.navigate(0,0)}},"~N");j(c$,"mouseEnterExit",function(a,b,d,c){this.vwr.tm.stereoDoubleDTI&&(b<<=1);this.setCurrent(a,b,d,0);c&&this.exitMeasurementMode("mouseExit")},"~N,~N,~N,~B");c(c$,"setMouseActions",function(a,
b,d){this.pressAction=JV.binding.Binding.getMouseAction(a,b,d?5:4);this.dragAction=JV.binding.Binding.getMouseAction(a,b,1);this.clickAction=JV.binding.Binding.getMouseAction(a,b,2)},"~N,~N,~B");j(c$,"mouseAction",function(a,b,d,c,f,e){if(this.vwr.getMouseEnabled())switch(JU.Logger.debuggingHigh&&(0!=a&&this.vwr.getBoolean(603979960))&&this.vwr.showString("mouse action: "+a+" "+e+" "+JV.binding.Binding.getMouseActionName(JV.binding.Binding.getMouseAction(f,e,a),!1),!1),this.vwr.tm.stereoDoubleDTI&&
(d<<=1),a){case 0:this.setCurrent(b,d,c,e);this.moved.setCurrent(this.current,0);if(null!=this.mp||this.hoverActive){this.clickAction=JV.binding.Binding.getMouseAction(this.clickedCount,e,0);this.checkClickAction(d,c,b,0);break}if(this.isZoomArea(d)){this.checkMotionRotateZoom(this.LEFT_DRAGGED,0,0,0,!1);break}8==this.vwr.currentCursor&&this.vwr.setCursor(0);break;case 4:this.setMouseMode();this.pressedCount=this.pressed.check(20,d,c,e,b,700)?this.pressedCount+1:1;1==this.pressedCount&&(this.vwr.checkInMotion(1),
this.setCurrent(b,d,c,e));this.pressAction=JV.binding.Binding.getMouseAction(this.pressedCount,e,4);this.vwr.setCursor(12);this.pressed.setCurrent(this.current,1);this.dragged.setCurrent(this.current,1);this.vwr.setFocus();this.dragGesture.setAction(this.dragAction,b);this.checkPressedAction(d,c,b);break;case 1:this.setMouseMode();this.setMouseActions(this.pressedCount,e,!1);a=d-this.dragged.x;f=c-this.dragged.y;this.setCurrent(b,d,c,e);this.dragged.setCurrent(this.current,-1);this.dragGesture.add(this.dragAction,
d,c,b);this.checkDragWheelAction(this.dragAction,d,c,a,f,b,1);break;case 5:this.setMouseActions(this.pressedCount,e,!0);this.setCurrent(b,d,c,e);this.vwr.spinXYBy(0,0,0);e=!this.pressed.check(10,d,c,e,b,9223372036854775E3);this.checkReleaseAction(d,c,b,e);break;case 3:if(this.vwr.isApplet&&!this.vwr.hasFocus())break;this.setCurrent(b,this.current.x,this.current.y,e);this.checkDragWheelAction(JV.binding.Binding.getMouseAction(0,e,3),this.current.x,this.current.y,0,c,b,3);break;case 2:this.setMouseMode();
this.clickedCount=1<f?f:this.clicked.check(10,0,0,e,b,700)?this.clickedCount+1:1;1==this.clickedCount&&this.setCurrent(b,d,c,e);this.setMouseActions(this.clickedCount,e,!1);this.clicked.setCurrent(this.current,this.clickedCount);this.vwr.setFocus();if(9!=this.apm&&this.bnd(JV.binding.Binding.getMouseAction(1,e,4),[31]))break;this.clickAction=JV.binding.Binding.getMouseAction(this.clickedCount,e,2);this.checkClickAction(d,c,b,this.clickedCount)}},"~N,~N,~N,~N,~N,~N");c(c$,"checkPressedAction",function(a,
b,d){var c=JV.binding.Binding.getButtonMods(this.pressAction),f=this.bnd(JV.binding.Binding.getMouseAction(1,c,4),[31]);if(0!=c){this.pressAction=this.vwr.notifyMouseClicked(a,b,this.pressAction,4);if(0==this.pressAction)return;c=JV.binding.Binding.getButtonMods(this.pressAction)}this.setMouseActions(this.pressedCount,c,!1);JU.Logger.debuggingHigh&&this.vwr.getBoolean(603979960)&&JU.Logger.debug(JV.binding.Binding.getMouseActionName(this.pressAction,!1));if(!this.isDrawOrLabelAction(this.dragAction)||
!this.vwr.checkObjectDragged(-2147483648,0,a,b,this.dragAction)){this.checkUserAction(this.pressAction,a,b,0,0,d,4);d=!1;switch(this.apm){case 32:d=this.bnd(this.clickAction,[0]);break;case 28:d=this.bnd(this.dragAction,[7,14]);break;case 26:case 36:case 37:case 27:d=this.bnd(this.dragAction,[7,14,27]);break;case 29:d=this.bnd(this.dragAction,[11,14]);break;case 30:d=this.bnd(this.dragAction,[11,14,27])}if(d){this.dragAtomIndex=this.vwr.findNearestAtomIndexMovable(a,b,!0);if(0<=this.dragAtomIndex&&
(32==this.apm||31==this.apm))34==this.bondPickingMode&&this.vwr.setModelkitProperty("bondAtomIndex",Integer.$valueOf(this.dragAtomIndex)),this.enterMeasurementMode(this.dragAtomIndex),this.mp.addPoint(this.dragAtomIndex,null,!1);a=this.vwr.getModelkitProperty("screenXY");this.mkBondPressed=null!=a&&this.pressed.inRange(10,a[0],a[1])}else this.bnd(this.pressAction,[23])?this.vwr.popupMenu(a,b,this.vwr.getBoolean(603983903)?"m":"j"):this.dragSelectedMode?(this.haveSelection=!f||0<=this.vwr.findNearestAtomIndexMovable(a,
b,!0))&&this.bnd(this.dragAction,[13,14])&&this.vwr.moveSelected(-2147483648,0,-2147483648,-2147483648,-2147483648,null,!1,!1,c):this.checkMotionRotateZoom(this.dragAction,a,0,0,!0)}},"~N,~N,~N");c(c$,"checkDragWheelAction",function(a,b,d,c,f,e,h){var j=JV.binding.Binding.getButtonMods(a);if(0!=j){var l=this.vwr.notifyMouseClicked(b,d,JV.binding.Binding.getMouseAction(this.pressedCount,j,h),h);if(0==l)return;0<l&&(a=l)}if(this.isRubberBandSelect(a))this.calcRectRubberBand(),this.vwr.refresh(3,"rubberBand selection");
else if(!this.checkUserAction(a,b,d,c,f,e,h))if(e=this.vwr.g.modelKitMode?this.vwr.getModelkit(!1).getRotateBondIndex():-1,0<=e&&(0<=this.dragAtomIndex||this.mkBondPressed||this.bnd(a,[26])))0<=this.dragAtomIndex&&(null==this.measurementQueued||0==this.measurementQueued.numSet?this.vwr.setPendingMeasurement(this.vwr.getModelkit(!1).setBondMeasure(e,this.measurementQueued=this.mp=this.getMP())):this.measurementQueued.refresh(null)),this.vwr.moveSelected(c,f,-2147483648,b,d,null,!1,!1,0<=this.dragAtomIndex?
0:16);else{e=null;if(0<=this.dragAtomIndex&&2!=this.apm)switch(this.apm){case 26:this.dragSelected(a,c,f,!0);return;case 36:case 37:case 27:case 30:e=this.vwr.ms.getAtoms(37==this.apm?1094717454:1094713360,JU.BSUtil.newAndSetBit(this.dragAtomIndex)),36==this.apm&&e.and(this.vwr.getAtomBitSet("ligand"));case 28:case 29:1==this.dragGesture.getPointCount()&&this.vwr.undoMoveActionClear(this.dragAtomIndex,2,!0);this.setMotion(13,!0);if(this.bnd(a,[27]))this.vwr.rotateSelected(this.getDegrees(c,!0),this.getDegrees(f,
!1),e);else{switch(this.apm){case 36:case 37:case 27:case 30:this.vwr.select(e,!1,0,!0)}this.vwr.moveAtomWithHydrogens(this.dragAtomIndex,c,f,this.bnd(a,[14])?-f:-2147483648,e)}return}if(0<=this.dragAtomIndex&&1==h&&this.bnd(this.clickAction,[0])&&32==this.apm)a=this.vwr.findNearestAtomIndexMovable(b,d,!1),0<=a?(null!=this.mp?this.mp.setCount(1):this.measuresEnabled&&this.enterMeasurementMode(a),this.addToMeasurement(a,null,!0),this.mp.colix=20):null!=this.mp&&(this.mp.setCount(1),this.mp.colix=23),
null!=this.mp&&(this.vwr.antialiased&&(b<<=1,d<<=1),this.mp.traceX=b,this.mp.traceY=d,this.vwr.refresh(3,"assignNew"));else if(!this.drawMode&&!this.labelMode&&this.bnd(a,[45]))this.vwr.translateXYBy(c,f);else if(this.dragSelectedMode&&this.haveSelection&&this.bnd(a,[13,27]))b=this.vwr.bsA().nextSetBit(0),0>b||(1==this.dragGesture.getPointCount()?this.vwr.undoMoveActionClear(b,2,!0):this.vwr.moveSelected(2147483647,0,-2147483648,-2147483648,-2147483648,null,!1,!1,j),this.dragSelected(a,c,f,!1));else{if(this.isDrawOrLabelAction(a)&&
(this.setMotion(13,!0),this.vwr.checkObjectDragged(this.dragged.x,this.dragged.y,b,d,a)))return;if(this.checkMotionRotateZoom(a,b,c,f,!0))this.vwr.tm.slabEnabled&&this.bnd(a,[39])?this.vwr.slabDepthByPixels(f):this.vwr.zoomBy(f);else if(this.bnd(a,[25]))this.vwr.rotateXYBy(this.getDegrees(c,!0),this.getDegrees(f,!1));else if(this.bnd(a,[29]))0==c&&1<Math.abs(f)?(this.setMotion(8,!0),this.vwr.zoomBy(f+(0<f?-1:1))):0==f&&1<Math.abs(c)&&(this.setMotion(13,!0),this.vwr.rotateZBy(-c+(0<c?1:-1),2147483647,
2147483647));else{if(this.vwr.tm.slabEnabled){if(this.bnd(a,[6])){this.vwr.depthByPixels(f);return}if(this.bnd(a,[38])){this.vwr.slabByPixels(f);return}if(this.bnd(a,[39])){this.vwr.slabDepthByPixels(f);return}}this.bnd(a,[46])?this.zoomByFactor(f,2147483647,2147483647):this.bnd(a,[28])&&(this.setMotion(13,!0),this.vwr.rotateZBy(-c,2147483647,2147483647))}}}},"~N,~N,~N,~N,~N,~N,~N");c(c$,"dragSelected",function(a,b,d,c){this.setMotion(13,!0);this.bnd(a,[27])&&this.vwr.getBoolean(603979785)?this.vwr.rotateSelected(this.getDegrees(b,
!0),this.getDegrees(d,!1),null):this.vwr.moveSelected(b,d,c&&this.bnd(a,[14])?-d:-2147483648,-2147483648,-2147483648,null,!0,!1,this.dragged.modifiers)},"~N,~N,~N,~B");c(c$,"checkReleaseAction",function(a,b,d,c){JU.Logger.debuggingHigh&&this.vwr.getBoolean(603979960)&&JU.Logger.debug(JV.binding.Binding.getMouseActionName(this.pressAction,!1));this.vwr.checkInMotion(0);this.vwr.setInMotion(!1);this.vwr.setCursor(0);this.dragGesture.add(this.dragAction,a,b,d);0<=this.dragAtomIndex&&(29==this.apm||30==
this.apm)&&this.minimize(!0);if(32==this.apm&&this.bnd(this.clickAction,[0]))null==this.mp||0>this.dragAtomIndex?this.exitMeasurementMode(null):34==this.bondPickingMode?(this.vwr.setModelkitProperty("bondAtomIndex",Integer.$valueOf(this.dragAtomIndex)),this.exitMeasurementMode(null)):this.assignNew();else if(this.dragAtomIndex=-1,this.mkBondPressed=!1,this.isRubberBandSelect(this.dragAction)&&this.selectRb(this.clickAction),this.rubberbandSelectionMode=this.b.name.equals("drag"),this.rectRubber.x=
2147483647,c&&this.vwr.notifyMouseClicked(a,b,JV.binding.Binding.getMouseAction(this.pressedCount,0,5),5),this.isDrawOrLabelAction(this.dragAction))this.vwr.checkObjectDragged(2147483647,0,a,b,this.dragAction);else if(this.haveSelection&&(this.dragSelectedMode&&this.bnd(this.dragAction,[13]))&&this.vwr.moveSelected(2147483647,0,-2147483648,-2147483648,-2147483648,null,!1,!1,this.dragged.modifiers),(!c||!this.checkUserAction(this.pressAction,a,b,0,0,d,5))&&this.vwr.getBoolean(603979780)&&this.bnd(this.dragAction,
[44]))a=this.getExitRate(),0<a&&this.vwr.spinXYBy(this.dragGesture.getDX(4,2),this.dragGesture.getDY(4,2),30*a*this.gestureSwipeFactor),this.vwr.g.logGestures&&this.vwr.log("$NOW$ swipe "+this.dragGesture+" "+a)},"~N,~N,~N,~B");c(c$,"checkClickAction",function(a,b,d,c){if(0<c){if(this.checkUserAction(this.clickAction,a,b,0,0,d,32768))return;this.clickAction=this.vwr.notifyMouseClicked(a,b,this.clickAction,32768);if(0==this.clickAction)return}JU.Logger.debuggingHigh&&this.vwr.getBoolean(603979960)&&
JU.Logger.debug(JV.binding.Binding.getMouseActionName(this.clickAction,!1));if(this.bnd(this.clickAction,[2])){if(this.vwr.frankClicked(a,b)){this.vwr.popupMenu(-a,b,"j");return}if(this.vwr.frankClickedModelKit(a,b)){this.vwr.popupMenu(10,0,"m");return}}d=null;var f=!1,e=!1,h=null;if(!this.drawMode&&(h=this.vwr.checkObjectClicked(a,b,this.clickAction),null!=h)){if(this.labelMode){this.pickLabel(h.get("atomIndex").intValue());return}f="bond".equals(h.get("type"));e="isosurface".equals(h.get("type"));
d=this.getPoint(h)}f&&(c=1);if(!(null!=d&&Float.isNaN(d.x))){var j=this.findNearestAtom(a,b,d,0<c);if(0==c&&32!=this.apm)null!=this.mp&&((null!=d||0==this.mp.getIndexOf(j))&&this.mp.addPoint(j,d,!1),this.mp.haveModified&&this.vwr.setPendingMeasurement(this.mp),this.vwr.refresh(3,"measurementPending"));else if(this.setMouseMode(),this.bnd(this.clickAction,[43])&&this.vwr.tm.stopMotion(),this.vwr.getBoolean(603979889)&&23==this.apm&&this.bnd(this.clickAction,[21]))this.vwr.navTranslatePercent(100*a/
this.vwr.getScreenWidth()-50,100*b/this.vwr.getScreenHeight()-50);else{if(f){if(this.bnd(this.clickAction,[34==this.bondPickingMode||33==this.bondPickingMode?0:5])){this.bondPicked(h.get("index").intValue());return}}else{if(e)return;if(32!=this.apm&&null!=this.mp&&this.bnd(this.clickAction,[20])){this.atomOrPointPicked(j,d);4==this.addToMeasurement(j,d,!1)&&this.toggleMeasurement();return}if(this.bnd(this.clickAction,[37])){null!=this.mp?(this.addToMeasurement(j,d,!0),this.toggleMeasurement()):!this.drawMode&&
(!this.labelMode&&!this.dragSelectedMode&&this.measuresEnabled)&&(this.enterMeasurementMode(j),this.addToMeasurement(j,d,!0));this.atomOrPointPicked(j,d);return}}this.isSelectAction(this.clickAction)?e||this.atomOrPointPicked(j,d):this.bnd(this.clickAction,[24])&&0>j&&this.reset()}}},"~N,~N,~N,~N");c(c$,"pickLabel",function(a){var b=this.vwr.ms.at[a].atomPropertyString(this.vwr,1825200146);2==this.pressedCount?(b=this.vwr.apiPlatform.prompt("Set label for atomIndex="+a,b,null,!1),null!=b&&(this.vwr.shm.setAtomLabel(b,
a),this.vwr.refresh(1,"label atom"))):this.setAtomsPicked(JU.BSUtil.newAndSetBit(a),"Label picked for atomIndex = "+a+": "+b)},"~N");c(c$,"checkUserAction",function(a,b,d,c,f,e,h){if(!this.b.isUserAction(a))return!1;for(var j=!1,l,n=this.b.getBindings(),m=a+"\t",r,p=n.keySet().iterator();p.hasNext()&&((r=p.next())||1);)if(0==r.indexOf(m)&&JU.AU.isAS(l=n.get(r))){var q=l[1],s=null;if(0<=q.indexOf("_ATOM")){var t=this.findNearestAtom(b,d,null,!0),q=JU.PT.rep(q,"_ATOM","({"+(0<=t?""+t:"")+"})");0<=t&&
(q=JU.PT.rep(q,"_POINT",JU.Escape.eP(this.vwr.ms.at[t])))}if(!this.drawMode&&(0<=q.indexOf("_POINT")||0<=q.indexOf("_OBJECT")||0<=q.indexOf("_BOND"))){t=this.vwr.checkObjectClicked(b,d,a);if(null!=t&&null!=(s=t.get("pt")))t.get("type").equals("bond")&&(q=JU.PT.rep(q,"_BOND","[{"+t.get("index")+"}]")),q=JU.PT.rep(q,"_POINT",JU.Escape.eP(s)),q=JU.PT.rep(q,"_OBJECT",JU.Escape.escapeMap(t));q=JU.PT.rep(q,"_BOND","[{}]");q=JU.PT.rep(q,"_OBJECT","{}")}q=JU.PT.rep(q,"_POINT","{}");q=JU.PT.rep(q,"_ACTION",
""+a);q=JU.PT.rep(q,"_X",""+b);q=JU.PT.rep(q,"_Y",""+(this.vwr.getScreenHeight()-d));q=JU.PT.rep(q,"_DELTAX",""+c);q=JU.PT.rep(q,"_DELTAY",""+f);q=JU.PT.rep(q,"_TIME",""+e);q=JU.PT.rep(q,"_MODE",""+h);q.startsWith("+:")&&(j=!0,q=q.substring(2));this.vwr.evalStringQuiet(q)}return!j},"~N,~N,~N,~N,~N,~N,~N");c(c$,"checkMotionRotateZoom",function(a,b,d,c,f){b=this.bnd(a,[40])&&this.isZoomArea(this.pressed.x);var e=this.bnd(a,[25]),h=this.bnd(a,[29]);if(!b&&!e&&!h)return!1;a=(d=h&&(0==d||Math.abs(c)>5*
Math.abs(d)))||this.isZoomArea(this.moved.x)||this.bnd(a,[46])?8:e||h?13:this.bnd(a,[1])?12:0;this.setMotion(a,f);return d||b},"~N,~N,~N,~N,~B");c(c$,"getExitRate",function(){var a=this.dragGesture.getTimeDifference(2);return this.isMultiTouch?80<a?0:this.dragGesture.getSpeedPixelsPerMillisecond(2,1):10<a?0:this.dragGesture.getSpeedPixelsPerMillisecond(4,2)});c(c$,"isRubberBandSelect",function(a){return this.rubberbandSelectionMode&&this.bnd(a&-8193|32768,[35,34,32])},"~N");c(c$,"getRubberBand",function(){return this.rubberbandSelectionMode&&
2147483647!=this.rectRubber.x?this.rectRubber:null});c(c$,"calcRectRubberBand",function(){var a=this.vwr.antialiased?2:1;this.current.x<this.pressed.x?(this.rectRubber.x=this.current.x*a,this.rectRubber.width=(this.pressed.x-this.current.x)*a):(this.rectRubber.x=this.pressed.x*a,this.rectRubber.width=(this.current.x-this.pressed.x)*a);this.current.y<this.pressed.y?(this.rectRubber.y=this.current.y*a,this.rectRubber.height=(this.pressed.y-this.current.y)*a):(this.rectRubber.y=this.pressed.y*a,this.rectRubber.height=
(this.current.y-this.pressed.y)*a)});c(c$,"getDegrees",function(a,b){return 180*(a/Math.min(500,b?this.vwr.getScreenWidth():this.vwr.getScreenHeight()))*this.mouseDragFactor},"~N,~B");c(c$,"isZoomArea",function(a){return a>98*this.vwr.getScreenWidth()*(this.vwr.tm.stereoDoubleFull||this.vwr.tm.stereoDoubleDTI?2:1)/100},"~N");c(c$,"getPoint",function(a){var b=new JU.Point3fi;b.setT(a.get("pt"));b.mi=a.get("modelIndex").intValue();return b},"java.util.Map");c(c$,"findNearestAtom",function(a,b,d,c){a=
this.drawMode||null!=d?-1:this.vwr.findNearestAtomIndexMovable(a,b,!1);return 0<=a&&(c||null==this.mp)&&!this.vwr.slm.isInSelectionSubset(a)?-1:a},"~N,~N,JU.Point3fi,~B");c(c$,"isSelectAction",function(a){return this.bnd(a,[17])||!this.drawMode&&!this.labelMode&&1==this.apm&&this.bnd(a,[1])||this.dragSelectedMode&&this.bnd(this.dragAction,[27,13])||this.bnd(a,[22,35,32,34,36,30])},"~N");c(c$,"enterMeasurementMode",function(a){this.vwr.setPicked(a,!0);this.vwr.setCursor(1);this.vwr.setPendingMeasurement(this.mp=
this.getMP());this.measurementQueued=this.mp},"~N");c(c$,"getMP",function(){return J.api.Interface.getInterface("JM.MeasurementPending",this.vwr,"mouse").set(this.vwr.ms)});c(c$,"addToMeasurement",function(a,b,d){if(-1==a&&null==b||null==this.mp)return this.exitMeasurementMode(null),0;var c=this.mp.count;-2147483648!=this.mp.traceX&&2==c&&this.mp.setCount(c=1);return 4==c&&!d?c:this.mp.addPoint(a,b,!0)},"~N,JU.Point3fi,~B");c(c$,"resetMeasurement",function(){this.exitMeasurementMode(null);this.measurementQueued=
this.getMP()});c(c$,"exitMeasurementMode",function(a){null!=this.mp&&(this.vwr.setPendingMeasurement(this.mp=null),this.vwr.setCursor(0),null!=a&&this.vwr.refresh(3,a))},"~S");c(c$,"getSequence",function(){var a=this.measurementQueued.getAtomIndex(1),b=this.measurementQueued.getAtomIndex(2);if(!(0>a||0>b))try{var d=this.vwr.getSmilesOpt(null,a,b,1048576,null);this.vwr.setStatusMeasuring("measureSequence",-2,d,0)}catch(c){if(H(c,Exception))JU.Logger.error(c.toString());else throw c;}});c(c$,"minimize",
function(a){var b=this.dragAtomIndex;a&&(this.dragAtomIndex=-1,this.mkBondPressed=!1);this.vwr.dragMinimizeAtom(b)},"~B");c(c$,"queueAtom",function(a,b){var d=this.measurementQueued.addPoint(a,b,!0);0<=a&&this.vwr.setStatusAtomPicked(a,"Atom #"+d+":"+this.vwr.getAtomInfo(a),null,!1);return d},"~N,JU.Point3fi");c(c$,"setMotion",function(a,b){switch(this.vwr.currentCursor){case 3:break;default:this.vwr.setCursor(a)}b&&this.vwr.setInMotion(!0)},"~N,~B");c(c$,"zoomByFactor",function(a,b,d){0!=a&&(this.setMotion(8,
!0),this.vwr.zoomByFactor(Math.pow(this.mouseWheelFactor,a),b,d),this.moved.setCurrent(this.current,0),this.vwr.setInMotion(!0),this.zoomTrigger=!0,this.startHoverWatcher(!0))},"~N,~N,~N");c(c$,"runScript",function(a){this.vwr.script(a)},"~S");c(c$,"atomOrPointPicked",function(a,b){if(0>a){this.resetMeasurement();if(this.bnd(this.clickAction,[33])){this.runScript("select none");return}if(5!=this.apm&&6!=this.apm)return}var d=2;switch(this.apm){case 28:case 29:return;case 0:return;case 25:case 24:case 8:var d=
8==this.apm,c=25==this.apm;if(!this.bnd(this.clickAction,[d?5:3]))return;if(null==this.measurementQueued||0==this.measurementQueued.count||2<this.measurementQueued.count)this.resetMeasurement(),this.enterMeasurementMode(a);this.addToMeasurement(a,b,!0);if(2!=this.queueAtom(a,b))return;d=d||this.measurementQueued.isConnected(this.vwr.ms.at,2)?" DELETE":c?"STRUTS":"";this.runScript("connect "+this.measurementQueued.getMeasurementScript(" ",!0)+d);this.resetMeasurement();return;case 21:d++;case 20:d++;
case 18:case 19:case 22:if(!this.bnd(this.clickAction,[20]))return;if(null==this.measurementQueued||0==this.measurementQueued.count||this.measurementQueued.count>d)this.resetMeasurement(),this.enterMeasurementMode(a);this.addToMeasurement(a,b,!0);this.queueAtom(a,b);c=this.measurementQueued.count;1==c&&this.vwr.setPicked(a,!0);if(c<d)return;22==this.apm?this.getSequence():(this.vwr.setStatusMeasuring("measurePicked",d,this.measurementQueued.getStringDetail(),this.measurementQueued.value),(18==this.apm||
4==this.pickingStyleMeasure)&&this.runScript("measure "+this.measurementQueued.getMeasurementScript(" ",!0)));this.resetMeasurement();return}d=null!=this.mp&&1!=this.apm?1:this.apm;switch(d){case 3:if(!this.bnd(this.clickAction,[17]))return;null==b?this.zoomTo(a):this.runScript("zoomTo "+JU.Escape.eP(b));return;case 5:case 6:this.bnd(this.clickAction,[17])&&this.checkTwoAtomAction(b,a)}if(null==b){switch(d){case 1:!this.drawMode&&!this.labelMode&&this.bnd(this.clickAction,[1])?this.zoomTo(a):this.bnd(this.clickAction,
[17])&&this.vwr.setStatusAtomPicked(a,null,null,!1);return;case 2:this.bnd(this.clickAction,[19])&&(this.runScript("set labeltoggle {atomindex="+a+"}"),this.pickLabel(a));return;case 31:this.bnd(this.clickAction,[0])&&(this.vwr.invertRingAt(a,!0),this.vwr.setStatusAtomPicked(a,"invert stereo for atomIndex="+a,null,!1));return;case 7:this.bnd(this.clickAction,[4])&&(d=JU.BSUtil.newAndSetBit(a),this.vwr.deleteAtoms(d,!1),this.vwr.setStatusAtomPicked(a,"deleted: "+JU.Escape.eBS(d),null,!1));return}d=
"atomindex="+a;switch(this.apm){default:return;case 9:this.selectAtoms(d);break;case 10:this.selectAtoms("within(group, "+d+")");break;case 11:this.selectAtoms("within(chain, "+d+")");break;case 13:this.selectAtoms("within(polymer, "+d+")");break;case 14:this.selectAtoms("within(structure, "+d+")");break;case 12:this.selectAtoms("within(molecule, "+d+")");break;case 16:this.selectAtoms("within(model, "+d+")");break;case 17:this.selectAtoms("visible and within(element, "+d+")");break;case 15:this.selectAtoms("visible and within(site, "+
d+")")}this.vwr.clearClickCount();this.vwr.setStatusAtomPicked(a,null,null,!1)}},"~N,JU.Point3fi");c(c$,"assignNew",function(){this.vwr.getModelkit(!1).handleAssignNew(this.pressed,this.dragged,this.mp,this.dragAtomIndex)||this.exitMeasurementMode("bond dropped");this.exitMeasurementMode(null)});c(c$,"bondPicked",function(a){33==this.bondPickingMode&&this.vwr.undoMoveActionClear(-1,4146,!0);switch(this.bondPickingMode){case 33:this.vwr.setModelkitProperty("scriptAssignBond",Integer.$valueOf(a));break;
case 8:this.vwr.deleteBonds(JU.BSUtil.newAndSetBit(a))}},"~N");c(c$,"checkTwoAtomAction",function(a,b){var d=5==this.apm;if(this.vwr.tm.spinOn||this.vwr.tm.navOn||null!=this.vwr.getPendingMeasurement())this.resetMeasurement(),this.vwr.tm.spinOn&&this.runScript("spin off");else{2<=this.measurementQueued.count&&this.resetMeasurement();var c=this.measurementQueued.count;if(1==c)if(null==a){if(this.measurementQueued.getAtomIndex(1)==b)return}else if(0==this.measurementQueued.getAtom(1).distance(a))return;
if(0<=b||null!=a)c=this.queueAtom(b,a);2>c?d?this.vwr.scriptStatus(1==c?J.i18n.GT.$("pick one more atom in order to spin the model around an axis"):J.i18n.GT.$("pick two atoms in order to spin the model around an axis")):this.vwr.scriptStatus(1==c?J.i18n.GT.$("pick one more atom in order to display the symmetry relationship"):J.i18n.GT.$("pick two atoms in order to display the symmetry relationship between them")):(c=this.measurementQueued.getMeasurementScript(" ",!1),d?this.runScript("spin"+c+" "+
this.vwr.getInt(553648157)):this.runScript("draw symop "+c+";show symop "+c))}},"JU.Point3fi,~N");c(c$,"reset",function(){this.runScript("!reset")});c(c$,"selectAtoms",function(a){if(!(null!=this.mp||this.selectionWorking)){this.selectionWorking=!0;var b=this.rubberbandSelectionMode||this.bnd(this.clickAction,[35])?"selected and not ("+a+") or (not selected) and ":this.bnd(this.clickAction,[32])?"selected and not ":this.bnd(this.clickAction,[34])?"selected or ":0==this.clickAction||this.bnd(this.clickAction,
[36])?"selected tog ":this.bnd(this.clickAction,[30])?"":null;if(null!=b)try{var d=this.vwr.getAtomBitSetEval(null,b+("("+a+")"));this.setAtomsPicked(d,"selected: "+JU.Escape.eBS(d));this.vwr.refresh(3,"selections set")}catch(c){if(!H(c,Exception))throw c;}this.selectionWorking=!1}},"~S");c(c$,"setAtomsPicked",function(a,b){this.vwr.select(a,!1,0,!1);this.vwr.setStatusAtomPicked(-1,b,null,!1)},"JU.BS,~S");c(c$,"selectRb",function(a){var b=this.vwr.ms.findAtomsInRectangle(this.rectRubber);0<b.length()&&
(b=JU.Escape.eBS(b),this.bnd(a,[34])?this.runScript("selectionHalos on;select selected or "+b):this.bnd(a,[32])?this.runScript("selectionHalos on;select selected and not "+b):this.runScript("selectionHalos on;select selected tog "+b));this.vwr.refresh(3,"mouseReleased")},"~N");c(c$,"toggleMeasurement",function(){if(null!=this.mp){var a=this.mp.count;2<=a&&4>=a&&this.runScript("!measure "+this.mp.getMeasurementScript(" ",!0));this.exitMeasurementMode(null)}});c(c$,"zoomTo",function(a){this.runScript("zoomTo (atomindex="+
a+")");this.vwr.setStatusAtomPicked(a,null,null,!1)},"~N");c(c$,"userActionEnabled",function(a){return this.vwr.isFunction(JV.ActionManager.getActionName(a).toLowerCase())},"~N");c(c$,"userAction",function(a,b){if(!this.userActionEnabled(a))return!1;var d=JS.ScriptEval.runUserAction(JV.ActionManager.getActionName(a),b,this.vwr);return!JS.SV.vF.equals(d)},"~N,~A");E(c$);c$.actionInfo=c$.prototype.actionInfo=
Array(47);c$.actionNames=c$.prototype.actionNames=Array(47);E(c$);JV.ActionManager.pickingModeNames="off identify label center draw spin symmetry deleteatom deletebond atom group chain molecule polymer structure site model element measure distance angle torsion sequence navigate connect struts dragselected dragmolecule dragatom dragminimize dragminimizemolecule invertstereo assignatom assignbond rotatebond identifybond dragligand dragmodel".$plit(" ");
E(c$,"pickingStyleNames",null);JV.ActionManager.pickingStyleNames="toggle selectOrToggle extendedSelect drag measure measureoff".$plit(" ");E(c$,"MAX_DOUBLE_CLICK_MILLIS",700,"MININUM_GESTURE_DELAY_MILLISECONDS",10,"SLIDE_ZOOM_X_PERCENT",98,"DEFAULT_MOUSE_DRAG_FACTOR",1,"DEFAULT_MOUSE_WHEEL_FACTOR",1.15,"DEFAULT_GESTURE_SWIPE_FACTOR",1,"XY_RANGE",10);c$=t(function(){this.time=this.y=this.x=this.index=0;p(this,arguments)},JV,"MotionPoint");c(c$,"set",function(a,b,d,c){this.index=a;this.x=b;this.y=
d;this.time=c},"~N,~N,~N,~N");j(c$,"toString",function(){return"[x = "+this.x+" y = "+this.y+" time = "+this.time+" ]"});c$=t(function(){this.action=0;this.nodes=null;this.time0=this.ptNext=0;this.vwr=null;p(this,arguments)},JV,"Gesture");q(c$,function(a,b){this.vwr=b;this.nodes=Array(a);for(var d=0;d<a;d++)this.nodes[d]=new JV.MotionPoint},"~N,JV.Viewer");c(c$,"setAction",function(a,b){this.action=a;this.ptNext=0;this.time0=b;for(var d=0;d<this.nodes.length;d++)this.nodes[d].index=-1},"~N,~N");c(c$,
"add",function(a,b,d,c){this.action=a;this.getNode(this.ptNext).set(this.ptNext,b,d,c-this.time0);this.ptNext++;return this.ptNext},"~N,~N,~N,~N");c(c$,"getTimeDifference",function(a){a=this.getPointCount2(a,0);if(2>a)return 0;var b=this.getNode(this.ptNext-1);a=this.getNode(this.ptNext-a);return b.time-a.time},"~N");c(c$,"getSpeedPixelsPerMillisecond",function(a,b){a=this.getPointCount2(a,b);if(2>a)return 0;var d=this.getNode(this.ptNext-1-b),c=this.getNode(this.ptNext-a-b),f=360*((d.x-c.x)/this.vwr.getScreenWidth()),
e=360*((d.y-c.y)/this.vwr.getScreenHeight());return Math.sqrt(f*f+e*e)/(d.time-c.time)},"~N,~N");c(c$,"getDX",function(a,b){a=this.getPointCount2(a,b);if(2>a)return 0;var d=this.getNode(this.ptNext-1-b),c=this.getNode(this.ptNext-a-b);return d.x-c.x},"~N,~N");c(c$,"getDY",function(a,b){a=this.getPointCount2(a,b);if(2>a)return 0;var d=this.getNode(this.ptNext-1-b),c=this.getNode(this.ptNext-a-b);return d.y-c.y},"~N,~N");c(c$,"getPointCount",function(){return this.ptNext});c(c$,"getPointCount2",function(a,
b){a>this.nodes.length-b&&(a=this.nodes.length-b);for(var d=a+1;0<=--d&&!(0<=this.getNode(this.ptNext-d-b).index););return d},"~N,~N");c(c$,"getNode",function(a){return this.nodes[(a+this.nodes.length+this.nodes.length)%this.nodes.length]},"~N");j(c$,"toString",function(){return 0==this.nodes.length?""+this:JV.binding.Binding.getMouseActionName(this.action,!1)+" nPoints = "+this.ptNext+" "+this.nodes[0]})});s("JV");v(["JU.BS"],"JV.AnimationManager",["J.api.Interface","JU.BSUtil"],function(){c$=t(function(){this.vwr=
this.animationThread=null;this.animationOn=!1;this.lastFrameDelayMs=this.firstFrameDelayMs=this.animationFps=0;this.bsVisibleModels=null;this.animationReplayMode=1073742070;this.animationFrames=this.bsDisplay=null;this.animationPaused=this.isMovie=!1;this.morphCount=this.caf=this.cmi=0;this.currentDirection=this.animationDirection=1;this.frameStep=this.lastFrameIndex=this.firstFrameIndex=0;this.backgroundModelIndex=-1;this.firstFrameDelay=this.currentMorphModel=0;this.lastFrameDelay=1;this.intAnimThread=
this.lastModelPainted=this.lastFramePainted=0;this.cai=-1;p(this,arguments)},JV,"AnimationManager");O(c$,function(){this.bsVisibleModels=new JU.BS});q(c$,function(a){this.vwr=a},"JV.Viewer");c(c$,"setAnimationOn",function(a){a!=this.animationOn&&(!a||this.vwr.headless?this.stopThread(!1):(this.vwr.tm.spinOn||this.vwr.refresh(3,"Anim:setAnimationOn"),this.setAnimationRange(-1,-1),this.resumeAnimation()))},"~B");c(c$,"stopThread",function(a){var b=!1;null!=this.animationThread&&(this.animationThread.interrupt(),
this.animationThread=null,b=!0);this.animationPaused=a;b&&!this.vwr.tm.spinOn&&this.vwr.refresh(3,"Viewer:setAnimationOff");this.animation(!1);this.vwr.setStatusFrameChanged(!1,!1)},"~B");c(c$,"setAnimationNext",function(){return this.setAnimationRelative(this.animationDirection)});c(c$,"currentIsLast",function(){return this.isMovie?this.lastFramePainted==this.caf:this.lastModelPainted==this.cmi});c(c$,"currentFrameIs",function(a){var b=this.cmi;return 0==this.morphCount?b==a:0.001>Math.abs(this.currentMorphModel-
a)},"~N");c(c$,"clear",function(){this.setMovie(null);this.initializePointers(0);this.setAnimationOn(!1);this.setModel(0,!0);this.currentDirection=1;this.cai=-1;this.setAnimationDirection(1);this.setAnimationFps(10);this.setAnimationReplayMode(1073742070,0,0);this.initializePointers(0)});c(c$,"getModelSpecial",function(a){switch(a){case -1:if(null!=this.animationFrames)return"1";a=this.firstFrameIndex;break;case 0:if(0<this.morphCount)return"-"+(1+this.currentMorphModel);a=this.cmi;break;case 1:if(null!=
this.animationFrames)return""+this.animationFrames.length;a=this.lastFrameIndex}return this.vwr.getModelNumberDotted(a)},"~N");c(c$,"setDisplay",function(a){this.bsDisplay=null==a||a.isEmpty()?null:JU.BSUtil.copy(a)},"JU.BS");c(c$,"setMorphCount",function(a){this.morphCount=this.isMovie?0:a},"~N");c(c$,"morph",function(a){var b=A(a);0.001>Math.abs(b-a)?a=b:0.999<Math.abs(b-a)&&(a=b+=1);a-=b;b-=1;if(0==a)this.currentMorphModel=b,this.setModel(b,!0);else{var d;this.setModel(b,!0);d=b+1;this.currentMorphModel=
b+a;d==b||(0>d||0>b)||this.vwr.ms.morphTrajectories(b,d,a)}},"~N");c(c$,"setModel",function(a,b){0>a&&this.stopThread(!1);var d=this.cmi,c=this.vwr.ms,f=null==c?0:c.mc;if(1==f)this.cmi=a=0;else if(0>a||a>=f)a=-1;var c=null,e=!1;if(this.cmi!=a){if(0<f){var f=this.vwr.ms,h=f.isJmolDataFrameForModel(a),j=f.isJmolDataFrameForModel(this.cmi);j&&f.setJmolDataFrame(null,-1,this.cmi);-1!=this.cmi&&this.vwr.saveModelOrientation();if(j||h)c=f.getJmolFrameType(a)+" "+a+" <--  "+this.cmi+" "+f.getJmolFrameType(this.cmi),
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this.animationOn||this.resumeAnimation()});c(c$,"repaintDone",function(){this.lastModelPainted=this.cmi;this.lastFramePainted=this.caf});c(c$,"resumeAnimation",function(){0>this.cmi&&this.setAnimationRange(this.firstFrameIndex,this.lastFrameIndex);1>=this.getFrameCount()?this.animation(!1):(this.animation(!0),this.animationPaused=!1,null==this.animationThread&&(this.intAnimThread++,this.animationThread=J.api.Interface.getOption("thread.AnimationThread",this.vwr,"script"),this.animationThread.setManager(this,
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function(a){return this.isMovie?this.animationFrames[a]-1:a},"~N");c(c$,"getFrameCount",function(){return this.isMovie?this.animationFrames.length:this.vwr.ms.mc});c(c$,"setFrame",function(a){try{if(this.isMovie){var b=this.modelIndexForFrame(a);this.caf=a;a=b}else this.caf=a;this.setModel(a,!0)}catch(d){if(!H(d,Exception))throw d;}},"~N");c(c$,"getUnitCellAtomIndex",function(){return this.cai});c(c$,"setUnitCellAtomIndex",function(a){this.cai=a},"~N");c(c$,"setViewer",function(a){this.vwr.ms.setTrajectory(this.cmi);
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function(){var a=0;this.bsVisibleModels.clearAll();0<=this.backgroundModelIndex&&(this.bsVisibleModels.set(this.backgroundModelIndex),a=1);if(0<=this.cmi)return this.bsVisibleModels.set(this.cmi),++a;if(0==this.frameStep)return a;for(var b=0,a=0,d=this.firstFrameIndex;d!=this.lastFrameIndex;d+=this.frameStep){var c=this.modelIndexForFrame(d);this.vwr.ms.isJmolDataFrameForModel(c)||(this.bsVisibleModels.set(c),a++,b=d)}c=this.modelIndexForFrame(this.lastFrameIndex);if(this.firstFrameIndex==this.lastFrameIndex||
!this.vwr.ms.isJmolDataFrameForModel(c)||0==a)this.bsVisibleModels.set(c),0==a&&(this.firstFrameIndex=this.lastFrameIndex),a=0;1==a&&0>this.cmi&&this.setFrame(b);return a});c(c$,"animation",function(a){this.animationOn=a;this.vwr.setBooleanProperty("_animating",a)},"~B");c(c$,"setAnimationRelative",function(a){a=this.getFrameStep(a);var b=(this.isMovie?this.caf:this.cmi)+a,d=0,c=0,f;0<this.morphCount?(d=1/(this.morphCount+1),c=this.currentMorphModel+a*d,f=this.isNotInRange(c)):f=this.isNotInRange(b);
if(f)switch(this.animationReplayMode){case 1073742070:return!1;case 528411:c=b=this.animationDirection==this.currentDirection?this.firstFrameIndex:this.lastFrameIndex;break;case 1073742082:this.currentDirection=-this.currentDirection,b-=2*a,c-=2*a*d}if(1>this.morphCount){if(0>b||b>=this.getFrameCount())return!1;this.setFrame(b);return!0}this.morph(c+1);return!0},"~N");c(c$,"isNotInRange",function(a){var b=a-0.001;return b>this.firstFrameIndex&&b>this.lastFrameIndex||(b=a+0.001)<this.firstFrameIndex&&
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4),f="      ".toCharArray();JV.binding.Binding.includes(a,2)&&(d.append("CTRL+"),f[5]="C");!c&&JV.binding.Binding.includes(a,8)&&(d.append("ALT+"),f[4]="A");JV.binding.Binding.includes(a,1)&&(d.append("SHIFT+"),f[3]="S");JV.binding.Binding.includes(a,16)?(f[2]="L",d.append("LEFT")):JV.binding.Binding.includes(a,4)?(f[2]="R",d.append("RIGHT")):c?(f[2]="M",d.append("MIDDLE")):JV.binding.Binding.includes(a,32)&&(f[2]="W",d.append("WHEEL"));JV.binding.Binding.includes(a,512)&&(d.append("+double"),f[1]=
"2");JV.binding.Binding.includes(a,4096)?(d.append("+down"),f[0]="1"):JV.binding.Binding.includes(a,8192)?(d.append("+drag"),f[0]="2"):JV.binding.Binding.includes(a,16384)?(d.append("+up"),f[0]="3"):JV.binding.Binding.includes(a,32768)&&(d.append("+click"),f[0]="4");return b?String.instantialize(f)+":"+d.toString():d.toString()},"~N,~B");c(c$,"getBindings",function(){return this.bindings});q(c$,function(){});c(c$,"bindAction",function(a,b){this.addBinding(a+"\t"+b,B(-1,[a,b]))},"~N,~N");c(c$,"bindName",
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d)}},"~N");c(c$,"addBinding",function(a,b){JU.Logger.debugging&&JU.Logger.debug("adding binding "+a+"\t==\t"+JU.Escape.e(b));this.bindings.put(a,b)},"~S,~O");c(c$,"removeBinding",function(a,b){JU.Logger.debugging&&JU.Logger.debug("removing binding "+b);null==a?this.bindings.remove(b):a.remove()},"java.util.Iterator,~S");c(c$,"unbindUserAction",function(a){var b=this.bindings.keySet().iterator();for(a="\t"+a;b.hasNext();){var d=b.next();d.endsWith(a)&&this.removeBinding(b,d)}},"~S");c(c$,"unbindMouseAction",
function(a){var b=this.bindings.keySet().iterator();for(a+="\t";b.hasNext();){var d=b.next();d.startsWith(a)&&this.removeBinding(b,d)}},"~N");c(c$,"isBound",function(a,b){return this.bindings.containsKey(a+"\t"+b)},"~N,~N");c(c$,"isUserAction",function(a){return this.bindings.containsKey(a+"\t")},"~N");c(c$,"getBindingInfo",function(a,b,d){var c=new JU.SB;d=null==d||d.equalsIgnoreCase("all")?null:d.toLowerCase();for(var f=Array(a.length),e=new JU.Lst,h,j=this.bindings.values().iterator();j.hasNext()&&
((h=j.next())||1);)if(!n(h,Boolean))if(JU.AU.isAS(h)){var l=h[0],p=h[1];(null==d||0<=d.indexOf("user")||0<=l.indexOf(d)||0<=p.indexOf(d))&&e.addLast(h)}else p=h,l=p[1],null==f[l]&&(f[l]=new JU.Lst),p=JV.binding.Binding.getMouseActionName(p[0],!0),(null==d||0<=(b[l]+";"+a[l]+";"+p).toLowerCase().indexOf(d))&&f[l].addLast(p);for(l=0;l<a.length;l++){var m;null==f[l]||0==(m=f[l].size())||this.addInfo(c,f[l].toArray(Array(m)),b[l],a[l])}for(l=0;l<e.size();l++)p=e.get(l),this.addInfo(c,u(-1,["USER:::"+
p[0]]),"user-defined",p[1]);return c.toString()},"~A,~A,~S");c(c$,"addInfo",function(a,b,d,c){java.util.Arrays.sort(b);JU.PT.leftJustify(a,"                      ",d);a.append("\t");d="";for(var f=a.length(),e=0;e<b.length;e++)a.append(d).append(b[e].substring(7)),d=", ";f=a.length()-f;20>f&&a.append("                 ".substring(0,20-f));a.append("\t").append(c).appendC("\n")},"JU.SB,~A,~S,~S");c$.includes=c(c$,"includes",function(a,b){return(a&b)==b},"~N,~N");c$.newBinding=c(c$,"newBinding",function(a,
b){return J.api.Interface.getInterface("JV.binding."+b+"Binding",a,"script")},"JV.Viewer,~S");E(c$,"LEFT",16,"MIDDLE",8,"RIGHT",4,"WHEEL",32,"ALT",8,"CTRL",2,"SHIFT",1,"CTRL_ALT",10,"CTRL_SHIFT",3,"MAC_COMMAND",20,"BUTTON_MASK",28,"BUTTON_MODIFIER_MASK",63,"SINGLE",256,"DOUBLE",512,"COUNT_MASK",768,"DOWN",4096,"DRAG",8192,"UP",16384,"CLICK",32768,"MODE_MASK",61440)});s("JV.binding");v(["JV.binding.JmolBinding"],"JV.binding.DragBinding",null,function(){c$=D(JV.binding,"DragBinding",JV.binding.JmolBinding);
q(c$,function(){I(this,JV.binding.DragBinding,[]);this.set("drag")});j(c$,"setSelectBindings",function(){this.bindAction(33040,30);this.bindAction(33041,35);this.bindAction(33048,34);this.bindAction(33049,32);this.bindAction(4368,31);this.bindAction(8464,13);this.bindAction(33040,17)})});s("JV.binding");v(["JV.binding.Binding"],"JV.binding.JmolBinding",null,function(){c$=D(JV.binding,"JmolBinding",JV.binding.Binding);q(c$,function(){I(this,JV.binding.JmolBinding,[]);this.set("toggle")});c(c$,"set",
function(a){this.name=a;this.setGeneralBindings();this.setSelectBindings()},"~S");c(c$,"setSelectBindings",function(){this.bindAction(33296,30);this.bindAction(33040,36)});c(c$,"setGeneralBindings",function(){this.bindAction(8474,45);this.bindAction(8454,45);this.bindAction(8721,45);this.bindAction(8712,45);this.bindAction(8464,25);this.bindAction(8720,25);this.bindAction(8472,28);this.bindAction(8453,28);this.bindAction(8465,29);this.bindAction(8456,29);this.bindAction(288,46);this.bindAction(8464,
40);this.bindAction(8464,16);this.bindAction(4370,23);this.bindAction(4356,23);this.bindAction(33040,2);this.bindAction(8467,38);this.bindAction(8723,6);this.bindAction(8475,39);this.bindAction(290,46);this.bindAction(289,46);this.bindAction(291,46);this.bindAction(290,38);this.bindAction(289,6);this.bindAction(291,39);this.bindAction(8464,44);this.bindAction(8464,41);this.bindAction(8465,42);this.bindAction(8473,13);this.bindAction(8465,14);this.bindAction(8472,27);this.bindAction(8465,26);this.bindAction(8464,
10);this.bindAction(8472,9);this.bindAction(8465,8);this.bindAction(33297,24);this.bindAction(33288,24);this.bindAction(33296,43);this.bindAction(8464,7);this.bindAction(8464,11);this.bindAction(8464,12);this.bindAction(33040,17);this.bindAction(33040,22);this.bindAction(33040,19);this.bindAction(33040,20);this.bindAction(33296,37);this.bindAction(33040,18);this.bindAction(33043,21);this.bindAction(33040,4);this.bindAction(33040,5);this.bindAction(33040,3);this.bindAction(33040,0);this.bindAction(33043,
1)})});s("JV");v(null,"JV.ColorManager","java.lang.Character $.Float JU.AU J.c.PAL JU.C $.ColorEncoder $.Elements $.Logger JV.JC".split(" "),function(){c$=t(function(){this.colorData=this.altArgbsCpk=this.argbsCpk=this.g3d=this.vwr=this.ce=null;this.isDefaultColorRasmol=!1;this.colixRubberband=22;this.colixBackgroundContrast=0;p(this,arguments)},JV,"ColorManager");q(c$,function(a,b){this.vwr=a;this.ce=new JU.ColorEncoder(null,a);this.g3d=b;this.argbsCpk=J.c.PAL.argbsCpk;this.altArgbsCpk=JU.AU.arrayCopyRangeI(JV.JC.altArgbsCpk,
0,-1)},"JV.Viewer,JU.GData");c(c$,"setDefaultColors",function(a){a?(this.isDefaultColorRasmol=!0,this.argbsCpk=JU.AU.arrayCopyI(JU.ColorEncoder.getRasmolScale(),-1)):(this.isDefaultColorRasmol=!1,this.argbsCpk=J.c.PAL.argbsCpk);this.altArgbsCpk=JU.AU.arrayCopyRangeI(JV.JC.altArgbsCpk,0,-1);this.ce.createColorScheme(a?"Rasmol=":"Jmol=",!0,!0);for(a=J.c.PAL.argbsCpk.length;0<=--a;)this.g3d.changeColixArgb(a,this.argbsCpk[a]);for(a=JV.JC.altArgbsCpk.length;0<=--a;)this.g3d.changeColixArgb(JU.Elements.elementNumberMax+
a,this.altArgbsCpk[a])},"~B");c(c$,"setRubberbandArgb",function(a){this.colixRubberband=0==a?0:JU.C.getColix(a)},"~N");c(c$,"setColixBackgroundContrast",function(a){this.colixBackgroundContrast=JU.C.getBgContrast(a)},"~N");c(c$,"getColixBondPalette",function(a,b){switch(b){case 19:return this.ce.getColorIndexFromPalette(a.getEnergy(),-2.5,-0.5,7,!1)}return 10},"JM.Bond,~N");c(c$,"getColixAtomPalette",function(a,b){var d=0,c;c=this.vwr.ms;switch(b){case 84:return null==this.colorData||a.i>=this.colorData.length||
Float.isNaN(this.colorData[a.i])?12:this.ce.getColorIndex(this.colorData[a.i]);case 0:case 1:c=a.getAtomicAndIsotopeNumber();if(c<JU.Elements.elementNumberMax)return this.g3d.getChangeableColix(c,this.argbsCpk[c]);d=c;c=JU.Elements.altElementIndexFromNumber(c);if(0<c)return this.g3d.getChangeableColix(JU.Elements.elementNumberMax+c,this.altArgbsCpk[c]);c=JU.Elements.getElementNumber(d);return this.g3d.getChangeableColix(c,this.argbsCpk[c]);case 2:return c=JU.ColorEncoder.quantize4(a.getPartialCharge(),
-1,1,JV.JC.PARTIAL_CHARGE_RANGE_SIZE),this.g3d.getChangeableColix(JV.JC.PARTIAL_CHARGE_COLIX_RED+c,JV.JC.argbsRwbScale[c]);case 3:return c=a.getFormalCharge()- -4,this.g3d.getChangeableColix(JV.JC.FORMAL_CHARGE_COLIX_RED+c,JV.JC.argbsFormalCharge[c]);case 68:case 5:return 68==b?(c=this.vwr.ms.getBfactor100Lo(),d=this.vwr.ms.getBfactor100Hi()):(c=0,d=1E4),this.ce.getColorIndexFromPalette(a.getBfactor100(),c,d,7,!1);case 86:return this.ce.getColorIndexFromPalette(a.group.getGroupParameter(1111490574),
-1,1,7,!1);case 70:return d=this.vwr.ms.getSurfaceDistanceMax(),this.ce.getColorIndexFromPalette(a.getSurfaceDistance100(),0,d,7,!1);case 24:return c=a.group.groupID,42<=c&&(c=24+"PGCATU".indexOf(Character.toUpperCase(a.group.group1))-1),this.ce.getColorIndexFromPalette(c,0,0,17,!1);case 8:return this.ce.getColorIndexFromPalette(a.group.groupID,0,0,5,!1);case 9:return this.ce.getColorIndexFromPalette(a.group.groupID,0,0,4,!1);case 75:return this.ce.getColorIndexFromPalette(a.group.selectedIndex,0,
a.group.chain.selectedGroupCount-1,1,!1);case 87:return c=this.vwr.ms.am[a.mi],this.ce.getColorIndexFromPalette(a.group.getBioPolymerIndexInModel(),0,(c.isBioModel?c.getBioPolymerCount():0)-1,1,!1);case 76:return this.ce.getColorIndexFromPalette(a.group.getSelectedMonomerIndex(),0,a.group.getSelectedMonomerCount()-1,1,!1);case 77:return this.ce.getColorIndexFromPalette(c.getMoleculeIndex(a.i,!0),0,c.getMoleculeCountInModel(a.mi)-1,0,!1);case 14:return d=a.mi,this.ce.getColorIndexFromPalette(c.getAltLocIndexInModel(d,
a.altloc),0,c.getAltLocCountInModel(d),0,!1);case 15:return d=a.mi,this.ce.getColorIndexFromPalette(c.getInsertionCodeIndexInModel(d,a.group.getInsertionCode()),0,c.getInsertionCountInModel(d),0,!1);case 16:c=a.getAtomicAndIsotopeNumber();d=this.getJmolOrRasmolArgb(c,1073741991);break;case 17:c=a.getAtomicAndIsotopeNumber();d=this.getJmolOrRasmolArgb(c,1073742116);break;case 7:d=a.group.getProteinStructureSubType().getColor();break;case 10:c=a.getChainID(),null==JU.ColorEncoder.argbsChainAtom&&(JU.ColorEncoder.argbsChainAtom=
this.getArgbs(1140850689),JU.ColorEncoder.argbsChainHetero=this.getArgbs(1612709894)),c=((0>c?0:256<=c?c-256:c)&31)%JU.ColorEncoder.argbsChainAtom.length,d=(a.isHetero()?JU.ColorEncoder.argbsChainHetero:JU.ColorEncoder.argbsChainAtom)[c]}return 0==d?22:JU.C.getColix(d)},"JM.Atom,~N");c(c$,"getArgbs",function(a){return this.vwr.getJBR().getArgbs(a)},"~N");c(c$,"getJmolOrRasmolArgb",function(a,b){switch(b){case 1073741991:if(a>=JU.Elements.elementNumberMax)break;return this.ce.getArgbFromPalette(a,
0,0,2);case 1073742116:if(a>=JU.Elements.elementNumberMax)break;return this.ce.getArgbFromPalette(a,0,0,3);default:return b}return JV.JC.altArgbsCpk[JU.Elements.altElementIndexFromNumber(a)]},"~N,~N");c(c$,"setElementArgb",function(a,b){if(1073741991==b&&this.argbsCpk===J.c.PAL.argbsCpk)return 0;b=this.getJmolOrRasmolArgb(a,b);this.argbsCpk===J.c.PAL.argbsCpk&&(this.argbsCpk=JU.AU.arrayCopyRangeI(J.c.PAL.argbsCpk,0,-1),this.altArgbsCpk=JU.AU.arrayCopyRangeI(JV.JC.altArgbsCpk,0,-1));if(a<JU.Elements.elementNumberMax){if(2147483647==
b)return JU.C.getColix(this.argbsCpk[a]);this.argbsCpk[a]=b;this.g3d.changeColixArgb(a,b);return 0}a=JU.Elements.altElementIndexFromNumber(a);this.altArgbsCpk[a]=b;this.g3d.changeColixArgb(JU.Elements.elementNumberMax+a,b);return 0},"~N,~N");c(c$,"getPropertyColorRange",function(){return this.ce.isReversed?K(-1,[this.ce.hi,this.ce.lo]):K(-1,[this.ce.lo,this.ce.hi])});c(c$,"setPropertyColorRangeData",function(a,b){this.colorData=a;this.ce.currentPalette=this.ce.createColorScheme(this.vwr.g.propertyColorScheme,
!0,!1);this.ce.hi=-3.4028235E38;this.ce.lo=3.4028235E38;if(null!=a){for(var c=null==b,g,f=c?a.length-1:b.nextSetBit(0);0<=f;f=c?f-1:b.nextSetBit(f+1))if(!Float.isNaN(g=a[f]))this.ce.hi=Math.max(this.ce.hi,g),this.ce.lo=Math.min(this.ce.lo,g);this.setPropertyColorRange(this.ce.lo,this.ce.hi)}},"~A,JU.BS");c(c$,"setPropertyColorRange",function(a,b){this.ce.setRange(a,b,a>b);JU.Logger.debugging&&JU.Logger.debug('ColorManager: color "'+this.ce.getCurrentColorSchemeName()+'" range '+a+" "+b)},"~N,~N");
c(c$,"setPropertyColorScheme",function(a,b,c){var g=0==a.length;g&&(a="=");var f=this.getPropertyColorRange();this.ce.currentPalette=this.ce.createColorScheme(a,!0,c);g||this.setPropertyColorRange(f[0],f[1]);this.ce.isTranslucent=b},"~S,~B,~B");c(c$,"getColorSchemeList",function(a){a=null==a||0==a.length?this.ce.currentPalette:this.ce.createColorScheme(a,!0,!1);return JU.ColorEncoder.getColorSchemeList(this.ce.getColorSchemeArray(a))},"~S");c(c$,"getColorEncoder",function(a){if(null==a||0==a.length)return this.ce;
var b=new JU.ColorEncoder(this.ce,this.vwr);b.currentPalette=b.createColorScheme(a,!1,!0);return 2147483647==b.currentPalette?null:b},"~S")});s("JV");v(["javajs.api.BytePoster","java.util.Hashtable"],"JV.FileManager","java.io.BufferedInputStream $.BufferedReader java.lang.Boolean java.net.URL $.URLEncoder java.util.Map JU.AU $.BArray $.Base64 $.LimitedLineReader $.Lst $.OC $.PT $.Rdr $.SB J.api.Interface J.io.FileReader JS.SV JU.Escape $.Logger JV.JC $.JmolAsyncException $.Viewer".split(" "),function(){c$=
t(function(){this.jzu=this.spartanDoc=this.vwr=null;this.pathForAllFiles="";this.nameAsGiven="zapped";this.lastFullPathName=this.fullPathName=null;this.lastNameAsGiven="zapped";this.spardirCache=this.pngjCache=this.cache=this.appletProxy=this.appletDocumentBaseURL=this.fileName=null;p(this,arguments)},JV,"FileManager",null,javajs.api.BytePoster);O(c$,function(){this.cache=new java.util.Hashtable});q(c$,function(a){this.vwr=a;this.clear()},"JV.Viewer");c(c$,"spartanUtil",function(){return null==this.spartanDoc?
this.spartanDoc=J.api.Interface.getInterface("J.adapter.readers.spartan.SpartanUtil",this.vwr,"fm getSpartanUtil()").set(this):this.spartanDoc});c(c$,"getJzu",function(){return null==this.jzu?this.jzu=J.api.Interface.getOption("io.JmolUtil",this.vwr,"file"):this.jzu});c(c$,"clear",function(){this.setFileInfo(u(-1,[this.vwr.getZapName()]));this.spardirCache=null});c(c$,"setLoadState",function(a){this.vwr.getPreserveState()&&a.put("loadState",this.vwr.g.getLoadState(a))},"java.util.Map");c(c$,"getPathForAllFiles",
function(){return this.pathForAllFiles});c(c$,"setPathForAllFiles",function(a){0<a.length&&(!a.endsWith("/")&&!a.endsWith("|"))&&(a+="/");return this.pathForAllFiles=a},"~S");c(c$,"setFileInfo",function(a){null==a?(this.fullPathName=this.lastFullPathName,this.nameAsGiven=this.lastNameAsGiven):(this.fullPathName=a[0],this.fileName=a[Math.min(1,a.length-1)],this.nameAsGiven=a[Math.min(2,a.length-1)],this.nameAsGiven.equals("zapped")||(this.lastNameAsGiven=this.nameAsGiven,this.lastFullPathName=this.fullPathName))},
"~A");c(c$,"getFileInfo",function(){return u(-1,[this.fullPathName,this.fileName,this.nameAsGiven])});c(c$,"getFullPathName",function(a){var b=null!=this.fullPathName?this.fullPathName:this.nameAsGiven;return!a||!b.equals("zapped")?b:null!=this.lastFullPathName?this.lastFullPathName:this.lastNameAsGiven},"~B");c(c$,"getFileName",function(){return null!=this.fileName?this.fileName:this.nameAsGiven});c(c$,"getAppletDocumentBase",function(){return null==this.appletDocumentBaseURL?"":this.appletDocumentBaseURL.toString()});
c(c$,"setAppletContext",function(a){try{System.out.println('setting document base to "'+a+'"'),this.appletDocumentBaseURL=0==a.length?null:new java.net.URL(aa("java.net.URL"),a,null)}catch(b){if(H(b,java.net.MalformedURLException))System.out.println("error setting document base to "+a);else throw b;}},"~S");c(c$,"setAppletProxy",function(a){this.appletProxy=null==a||0==a.length?null:a},"~S");c(c$,"createAtomSetCollectionFromFile",function(a,b,c){null==b.get("atomDataOnly")&&this.setLoadState(b);var g=
a;a=this.vwr.resolveDatabaseFormat(a);!g.equals(a)&&(0>g.indexOf("/")&&JV.Viewer.hasDatabasePrefix(g))&&b.put("dbName",g);a.endsWith("%2D%")&&(g=b.get("filter"),b.put("filter",(null==g?"":g)+"2D"),a=a.substring(0,a.length-4));var f=a.indexOf("::"),g=0<=f?a.substring(f+2):a,f=0<=f?a.substring(0,f):null;JU.Logger.info("\nFileManager.getAtomSetCollectionFromFile("+g+")"+(a.equals(g)?"":" //"+a));var e=this.getClassifiedName(g,!0);if(1==e.length)return e[0];a=e[0];e=e[1];b.put("fullPathName",(null==f?
"":f+"::")+JV.FileManager.fixDOSName(a));this.vwr.getBoolean(603979879)&&this.vwr.getBoolean(603979825)&&this.vwr.getChimeMessenger().update(a);b=new J.io.FileReader(this.vwr,e,a,g,f,null,b,c);b.run();return b.getAtomSetCollection()},"~S,java.util.Map,~B");c(c$,"createAtomSetCollectionFromFiles",function(a,b,c){this.setLoadState(b);for(var g=Array(a.length),f=Array(a.length),e=Array(a.length),h=0;h<a.length;h++){var j=a[h].indexOf("::"),l=0<=j?a[h].substring(j+2):a[h],j=0<=j?a[h].substring(0,j):null,
n=this.getClassifiedName(l,!0);if(1==n.length)return n[0];g[h]=n[0];a[h]=JV.FileManager.fixDOSName(n[0]);e[h]=j;f[h]=l}b.put("fullPathNames",g);b.put("fileTypes",e);a=this.newFilesReader(g,f,e,null,b,c);a.run();return a.getAtomSetCollection()},"~A,java.util.Map,~B");c(c$,"createAtomSetCollectionFromString",function(a,b,c){this.setLoadState(b);var g=0<=a.indexOf("Viewer.AddHydrogens")?this.getFileInfo():null;b=new J.io.FileReader(this.vwr,"string",null,null,null,JU.Rdr.getBR(a),b,c);b.run();null!=
g&&this.setFileInfo(g);!c&&!n(b.getAtomSetCollection(),String)&&this.setFileInfo(u(-1,["5\n\nC 0 0 0\nH .63 .63 .63\nH -.63 -.63 .63\nH -.63 .63 -.63\nH .63 -.63 -.63"===a?"Jmol Model Kit":"string"]));return b.getAtomSetCollection()},"~S,java.util.Map,~B");c(c$,"createAtomSeCollectionFromStrings",function(a,b,c,g){if(!c.containsKey("isData")){var f='"'+this.vwr.getDataSeparator()+'"',e='"'+(g?"append":"model")+' inline"',h=new JU.SB;h.append('set dataSeparator "~~~next file~~~";\ndata ').append(e);
for(var j=0;j<a.length;j++)0<j&&h.append("~~~next file~~~"),h.append(a[j]);h.append("end ").append(e).append(";set dataSeparator ").append(f);b.appendSB(h)}this.setLoadState(c);JU.Logger.info("FileManager.getAtomSetCollectionFromStrings(string[])");b=Array(a.length);f=Array(a.length);for(j=0;j<a.length;j++)b[j]="string["+j+"]",f[j]=JV.FileManager.newDataReader(this.vwr,a[j]);a=this.newFilesReader(b,b,null,f,c,g);a.run();return a.getAtomSetCollection()},"~A,JU.SB,java.util.Map,~B");c(c$,"createAtomSeCollectionFromArrayData",
function(a,b,c){JU.Logger.info("FileManager.getAtomSetCollectionFromArrayData(Vector)");for(var g=a.size(),f=Array(g),e=Array(g),h=0;h<g;h++)f[h]="String["+h+"]",e[h]=JV.FileManager.newDataReader(this.vwr,a.get(h));a=this.newFilesReader(f,f,null,e,b,c);a.run();return a.getAtomSetCollection()},"JU.Lst,java.util.Map,~B");c$.newDataReader=c(c$,"newDataReader",function(a,b){var c=n(b,String)?"String":JU.AU.isAS(b)?"Array":n(b,JU.Lst)?"List":null;return null==c?null:J.api.Interface.getInterface("JU."+
c+"DataReader",a,"file").setData(b)},"JV.Viewer,~O");c(c$,"newFilesReader",function(a,b,c,g,f,e){var h=J.api.Interface.getOption("io.FilesReader",this.vwr,"file");h.set(this,this.vwr,a,b,c,g,f,e);return h},"~A,~A,~A,~A,java.util.Map,~B");c(c$,"createAtomSetCollectionFromDOM",function(a,b){var c=J.api.Interface.getOption("io.DOMReader",this.vwr,"file");c.set(this,this.vwr,a,b);c.run();return c.getAtomSetCollection()},"~O,java.util.Map");c(c$,"createAtomSetCollectionFromReader",function(a,b,c,g){a=
new J.io.FileReader(this.vwr,b,a,null,null,c,g,!1);a.run();return a.getAtomSetCollection()},"~S,~S,~O,java.util.Map");c(c$,"getBufferedInputStream",function(a){a=this.getBufferedReaderOrErrorMessageFromName(a,Array(2),!0,!0);return n(a,java.io.BufferedInputStream)?a:null},"~S");c(c$,"getBufferedInputStreamOrErrorMessageFromName",function(a,b,c,g,f,e,h){var j=null,l=null;b=h&&null==f?b=this.getPngjOrDroppedBytes(b,a):null;try{h&&(0<=a.indexOf(".png")&&null==this.pngjCache&&!this.vwr.getBoolean(603979960))&&
(this.pngjCache=new java.util.Hashtable);if(null==b){var p=0<=a.indexOf("?POST?_PNGJBIN_"),m=p||0<=a.indexOf("?POST?_PNGJ_");if(0<a.indexOf("?POST?_PNG_")||m){var r=Array(1),q=this.vwr.getImageAsBytes(m?"PNGJ":"PNG",0,0,-1,r);if(null!=r[0])return r[0];p?(f=q,a=JU.PT.rep(a,"?_","=_")):a=(new JU.SB).append(a).append("=").appendSB(JU.Base64.getBase64(q)).toString()}var s=JU.OC.urlTypeIndex(a),p=0<=s,m=null;if(p&&0<=(s=a.indexOf("?POST?")))m=a.substring(s+6),a=a.substring(0,s);var t=null!=this.appletDocumentBaseURL;
if(t||p){t&&(p&&null!=this.appletProxy)&&(a=this.appletProxy+"?url="+this.urlEncode(a));var u=t?new java.net.URL(this.appletDocumentBaseURL,a,null):new java.net.URL(aa("java.net.URL"),a,null);if(g)return null;a=u.toString();c&&0>a.toLowerCase().indexOf("password")&&JU.Logger.info("FileManager opening url "+a);l=this.vwr.apiPlatform.getURLContents(u,f,m,!1);q=null;if(n(l,JU.SB)){a=l;if(e&&!JU.Rdr.isBase64(a))return JU.Rdr.getBR(a.toString());q=JU.Rdr.getBytesFromSB(a)}else JU.AU.isAB(l)&&(q=l);null!=
q&&(l=JU.Rdr.getBIS(q))}else if(!h||null==(b=this.cacheGet(a,!0)))c&&JU.Logger.info("FileManager opening file "+a),l=this.vwr.apiPlatform.getBufferedFileInputStream(a);if(n(l,String))return l}j=null==b?l:JU.Rdr.getBIS(b);g&&(j.close(),j=null);return j}catch(v){if(H(v,Exception))try{null!=j&&j.close()}catch(w){if(!H(w,java.io.IOException))throw w;}else throw v;}return""+v},"~S,~S,~B,~B,~A,~B,~B");c$.getBufferedReaderForResource=c(c$,"getBufferedReaderForResource",function(a,b,c,g){g=a.vwrOptions.get("codePath")+
c+g;if(a.async){a=a.fm.cacheGet(g,!1);if(null==a)throw new JV.JmolAsyncException(g);return JU.Rdr.getBufferedReader(JU.Rdr.getBIS(a),null)}return a.fm.getBufferedReaderOrErrorMessageFromName(g,u(-1,[null,null]),!1,!0)},"JV.Viewer,~O,~S,~S");c(c$,"urlEncode",function(a){try{return java.net.URLEncoder.encode(a,"utf-8")}catch(b){if(H(b,java.io.UnsupportedEncodingException))return a;throw b;}},"~S");c(c$,"getFullPathNameOrError",function(a,b,c){var g=this.getClassifiedName(JV.JC.fixProtocol(a),!0);if(null==
g||null==g[0]||2>g.length)return u(-1,[null,"cannot read file name: "+a]);a=g[0];g=JV.FileManager.fixDOSName(g[0]);a=JU.Rdr.getZipRoot(a);b=this.getBufferedInputStreamOrErrorMessageFromName(a,g,!1,!b,null,!1,!b);c[0]=g;n(b,String)&&(c[1]=b);return b},"~S,~B,~A");c(c$,"getBufferedReaderOrErrorMessageFromName",function(a,b,c,g){a=JV.JC.fixProtocol(a);var f=this.cacheGet(a,!1),e=JU.AU.isAB(f),h=e?f:null;if(a.startsWith("cache://")){if(null==f)return"cannot read "+a;if(e)h=f;else return JU.Rdr.getBR(f)}f=
this.getClassifiedName(a,!0);if(null==f)return"cannot read file name: "+a;null!=b&&(b[0]=JV.FileManager.fixDOSName(f[0]));return this.getUnzippedReaderOrStreamFromName(f[0],h,!1,c,!1,g,null)},"~S,~A,~B,~B");c(c$,"getUnzippedReaderOrStreamFromName",function(a,b,c,g,f,e,h){if(e&&null==b){var j=a.endsWith(".spt")?u(-1,[null,null,null]):0>a.indexOf(".spardir")?null:this.spartanUtil().getFileList(a,f);if(null!=j)return j}a=JV.JC.fixProtocol(a);null==b&&(null!=(b=this.getCachedPngjBytes(a))&&null!=h)&&
h.put("sourcePNGJ",Boolean.TRUE);e=a=a.$replace("#_DOCACHE_","");f=null;0<=a.indexOf("|")&&(f=JU.PT.split(a.$replace("\\","/"),"|"),null==b&&JU.Logger.info("FileManager opening zip "+a),a=f[0]);a=null==b?this.getBufferedInputStreamOrErrorMessageFromName(a,e,!0,!1,null,!g,!0):JU.AU.isAB(b)?JU.Rdr.getBIS(b):b;try{if(n(a,String)||n(a,java.io.BufferedReader))return a;JU.Rdr.isGzipS(a)?a=JU.Rdr.getUnzippedInputStream(this.vwr.getJzt(),a):JU.Rdr.isBZip2S(a)&&(a=JU.Rdr.getUnzippedInputStreamBZip2(this.vwr.getJzt(),
a));if(JU.Rdr.isTar(a))return j=this.vwr.getJzt().getZipFileDirectory(a,f,1,g),n(j,String)?JU.Rdr.getBR(j):j;if(g&&null==f)return a;if(JU.Rdr.isCompoundDocumentS(a)){var l=J.api.Interface.getInterface("JU.CompoundDocument",this.vwr,"file");l.setDocStream(this.vwr.getJzt(),a);var p=l.getAllDataFiles("Molecule","Input").toString();return g?JU.Rdr.getBIS(p.getBytes()):JU.Rdr.getBR(p)}if(JU.Rdr.isMessagePackS(a)||JU.Rdr.isPickleS(a))return a;a=JU.Rdr.getPngZipStream(a,!0);if(JU.Rdr.isZipS(a)){if(c)return this.vwr.getJzt().newZipInputStream(a);
j=this.vwr.getJzt().getZipFileDirectory(a,f,1,g);return n(j,String)?JU.Rdr.getBR(j):j}return g?a:JU.Rdr.getBufferedReader(a,null)}catch(m){if(H(m,Exception))return m.toString();throw m;}},"~S,~O,~B,~B,~B,~B,java.util.Map");c(c$,"getZipDirectory",function(a,b,c){a=this.getBufferedInputStreamOrErrorMessageFromName(a,a,!1,!1,null,!1,c);return this.vwr.getJzt().getZipDirectoryAndClose(a,b?"JmolManifest":null)},"~S,~B,~B");c(c$,"getFileAsBytes",function(a,b){if(null==a)return null;var c=a,g=null;0<=a.indexOf("|")&&
(g=JU.PT.split(a,"|"),a=g[0]);var f=null!=g?null:this.getPngjOrDroppedBytes(c,a);if(null==f){c=this.getBufferedInputStreamOrErrorMessageFromName(a,c,!1,!1,null,!1,!0);if(n(c,String))return"Error:"+c;try{f=null!=b||null==g||1>=g.length||!JU.Rdr.isZipS(c)&&!JU.Rdr.isPngZipStream(c)&&!JU.Rdr.isTar(c)?JU.Rdr.getStreamAsBytes(c,b):this.vwr.getJzt().getZipFileContentsAsBytes(c,g,1),c.close()}catch(e){if(H(e,Exception))return e.toString();throw e;}}if(null==b||!JU.AU.isAB(f))return f;b.write(f,0,-1);return f.length+
" bytes"},"~S,JU.OC");c(c$,"getFileAsMap",function(a,b){var c=new java.util.Hashtable,g;if(null==a){g=Array(1);var f=this.vwr.getImageAsBytes(b,-1,-1,-1,g);if(null!=g[0])return c.put("_ERROR_",g[0]),c;g=JU.Rdr.getBIS(f)}else{f=Array(2);g=this.getFullPathNameOrError(a,!0,f);if(n(g,String))return c.put("_ERROR_",g),c;if(!this.checkSecurity(f[0]))return c.put("_ERROR_","java.io. Security exception: cannot read file "+f[0]),c}try{this.vwr.getJzt().readFileAsMap(g,c,a)}catch(e){if(H(e,Exception))c.clear(),
c.put("_ERROR_",""+e);else throw e;}return c},"~S,~S");c(c$,"getFileDataAsString",function(a,b,c,g,f){a[1]="";var e=a[0];if(null==e)return!1;c=this.getBufferedReaderOrErrorMessageFromName(e,a,!1,c);if(n(c,String))return a[1]=c,!1;if(f&&!this.checkSecurity(a[0]))return a[1]="java.io. Security exception: cannot read file "+a[0],!1;try{return JU.Rdr.readAllAsString(c,b,g,a,1)}catch(h){if(H(h,Exception))return!1;throw h;}},"~A,~N,~B,~B,~B");c(c$,"checkSecurity",function(a){if(!a.startsWith("file:"))return!0;
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0.2;this.pointGroupLinearTolerance=8;this.preserveState=!0;this.propertyColorScheme="roygb";this.quaternionFrame="p";this.saveProteinStructureState=!0;this.showModVecs=!1;this.showUnitCellDetails=!0;this.solventProbeRadius=1.2;this.scriptDelay=0;this.statusReporting=this.selectAllModels=!0;this.strandCountForStrands=5;this.strandCountForMeshRibbon=7;this.strutSpacing=6;this.strutLengthMaximum=7;this.strutDefaultRadius=0.3;this.strutsMultiple=!1;this.waitForMoveTo=this.useScriptQueue=this.useNumberLocalization=
this.useMinimizationThread=!0;this.noDelay=!1;this.vectorScale=1;this.vectorsCentered=this.vectorSymmetry=!1;this.vectorTrail=0;this.vibrationScale=this.vibrationPeriod=1;this.navigationPeriodic=this.navigationMode=this.hideNavigationPoint=this.wireframeRotation=!1;this.navigationSpeed=5;this.showNavigationPointAlways=!1;this.stereoState=null;this.modelKitMode=!1;this.objMad10=this.objStateOn=this.objColors=null;this.ellipsoidFill=this.ellipsoidArrows=this.ellipsoidArcs=this.ellipsoidDots=this.ellipsoidAxes=
!1;this.ellipsoidBall=!0;this.ellipsoidDotCount=200;this.ellipsoidAxisDiameter=0.02;this.testFlag4=this.testFlag3=this.testFlag2=this.testFlag1=!1;this.structureList=null;this.haveSetStructureList=!1;this.bondingVersion=0;p(this,arguments)},JV,"GlobalSettings");O(c$,function(){this.htUserVariables=new java.util.Hashtable;this.ptDefaultLattice=new JU.P3;this.objColors=B(7,0);this.objStateOn=ga(7,!1);this.objMad10=B(7,0);this.structureList=new java.util.Hashtable;this.structureList.put(J.c.STR.TURN,
K(-1,[30,90,-15,95]));this.structureList.put(J.c.STR.SHEET,K(-1,[-180,-10,70,180,-180,-45,-180,-130,140,180,90,180]));this.structureList.put(J.c.STR.HELIX,K(-1,[-160,0,-100,45]))});q(c$,function(a,b,c){this.vwr=a;this.htNonbooleanParameterValues=new java.util.Hashtable;this.htBooleanParameterFlags=new java.util.Hashtable;this.htPropertyFlagsRemoved=new java.util.Hashtable;this.loadFormat=this.pdbLoadFormat=JV.JC.databases.get("pdb");this.pdbLoadLigandFormat=JV.JC.databases.get("ligand");this.nmrUrlFormat=
JV.JC.databases.get("nmr");this.nmrPredictFormat=JV.JC.databases.get("nmrdb");this.pubChemFormat=JV.JC.databases.get("pubchem");this.resolverResolver=JV.JC.databases.get("resolverresolver");this.macroDirectory="https://chemapps.stolaf.edu/jmol/macros";null!=b&&(c||(this.setO("_pngjFile",b.getParameter("_pngjFile",!1)),this.htUserVariables=b.htUserVariables),this.debugScript=b.debugScript,this.disablePopupMenu=b.disablePopupMenu,this.messageStyleChime=b.messageStyleChime,this.defaultDirectory=b.defaultDirectory,
this.autoplayMovie=b.autoplayMovie,this.allowAudio=b.allowAudio,this.allowGestures=b.allowGestures,this.allowModelkit=b.allowModelkit,this.allowMultiTouch=b.allowMultiTouch,this.allowKeyStrokes=b.allowKeyStrokes,this.legacyAutoBonding=b.legacyAutoBonding,this.legacyHAddition=b.legacyHAddition,this.legacyJavaFloat=b.legacyJavaFloat,this.bondingVersion=b.bondingVersion,this.platformSpeed=b.platformSpeed,this.useScriptQueue=b.useScriptQueue,this.showTiming=b.showTiming,this.wireframeRotation=b.wireframeRotation,
this.testFlag1=b.testFlag1,this.testFlag2=b.testFlag2,this.testFlag3=b.testFlag3,this.testFlag4=b.testFlag4,this.nihResolverFormat=b.nihResolverFormat);null==this.nihResolverFormat&&(this.nihResolverFormat=JV.JC.databases.get("nci"));this.setCIR(this.nihResolverFormat);var g;c=0;for(var f=J.c.CBK.values();c<f.length&&((g=f[c])||1);c++)this.resetValue(g.name()+"Callback",b);this.setF("cameraDepth",3);this.setI("contextDepthMax",100);this.setI("depth",0);this.setF("gestureSwipeFactor",1);this.setB("hideNotSelected",
!1);this.setI("historyLevel",0);this.setO("hoverLabel","");this.setB("isKiosk",a.isKiosk());this.setO("logFile",a.getLogFileName());this.setI("logLevel",JU.Logger.getLogLevel());this.setF("mouseWheelFactor",1.15);this.setF("mouseDragFactor",1);this.setI("navFps",10);this.setI("navigationDepth",0);this.setI("navigationSlab",0);this.setI("navX",0);this.setI("navY",0);this.setI("navZ",0);this.setO("pathForAllFiles","");this.setB("perspectiveDepth",!0);this.setI("perspectiveModel",11);this.setO("picking",
"identify");this.setO("pickingStyle","toggle");this.setB("refreshing",!0);this.setI("rotationRadius",0);this.setI("scaleAngstromsPerInch",0);this.setI("scriptReportingLevel",0);this.setB("selectionHalos",!1);this.setB("showaxes",!1);this.setB("showboundbox",!1);this.setB("showfrank",!1);this.setB("showUnitcell",!1);this.setI("slab",100);this.setB("slabEnabled",!1);this.setF("slabrange",0);this.setI("spinX",0);this.setI("spinY",30);this.setI("spinZ",0);this.setI("spinFps",30);this.setF("visualRange",
5);this.setI("stereoDegrees",-5);this.setB("syncScript",a.sm.syncingScripts);this.setB("syncMouse",a.sm.syncingMouse);this.setB("syncStereo",a.sm.stereoSync);this.setB("windowCentered",!0);this.setB("zoomEnabled",!0);this.setI("_version",JV.JC.versionInt);this.setO("_versionDate",JV.Viewer.getJmolVersion());this.setB("axesWindow",!0);this.setB("axesMolecular",!1);this.setB("axesPosition",!1);this.setB("axesUnitcell",!1);this.setI("backgroundModel",0);this.setB("colorRasmol",!1);this.setO("currentLocalPath",
"");this.setO("defaultLattice","{0 0 0}");this.setO("defaultColorScheme","Jmol");this.setO("defaultDirectoryLocal","");this.setO("defaults","Jmol");this.setO("defaultVDW","Jmol");this.setO("exportDrivers","Idtf;Maya;Povray;Vrml;X3d;Stl;Tachyon;Obj");this.setI("propertyAtomNumberColumnCount",0);this.setI("propertyAtomNumberField",0);this.setI("propertyDataColumnCount",0);this.setI("propertyDataField",0);this.setB("undo",!0);this.setB("allowEmbeddedScripts",this.allowEmbeddedScripts);this.setB("allowGestures",
this.allowGestures);this.setB("allowKeyStrokes",this.allowKeyStrokes);this.setB("allowModelkit",this.allowModelkit);this.setB("allowMultiTouch",this.allowMultiTouch);this.setB("allowRotateSelected",this.allowRotateSelected);this.setB("allowMoveAtoms",this.allowMoveAtoms);this.setI("animationFps",this.animationFps);this.setB("antialiasImages",this.antialiasImages);this.setB("antialiasDisplay",this.antialiasDisplay);this.setB("antialiasTranslucent",this.antialiasTranslucent);this.setB("appendNew",this.appendNew);
this.setO("appletProxy",this.appletProxy);this.setB("applySymmetryToBonds",this.applySymmetryToBonds);this.setB("atomPicking",this.atomPicking);this.setO("atomTypes",this.atomTypes);this.setB("autoBond",this.autoBond);this.setB("autoFps",this.autoFps);this.setI("axesMode",603979808==this.axesMode?2:603979804==this.axesMode?1:0);this.setF("axesScale",this.axesScale);this.setF("axesOffset",this.axesOffset);this.setB("axesOrientationRasmol",this.axesOrientationRasmol);this.setF("cartoonBlockHeight",
this.cartoonBlockHeight);this.setB("cartoonBlocks",this.cartoonBlocks);this.setB("cartoonSteps",this.cartoonSteps);this.setB("bondModeOr",this.bondModeOr);this.setB("bondPicking",this.bondPicking);this.setI("bondRadiusMilliAngstroms",this.bondRadiusMilliAngstroms);this.setF("bondTolerance",this.bondTolerance);this.setB("cartoonBaseEdges",this.cartoonBaseEdges);this.setB("cartoonFancy",this.cartoonFancy);this.setB("cartoonLadders",this.cartoonLadders);this.setB("cartoonLadders",this.cartoonRibose);
this.setB("cartoonRockets",this.cartoonRockets);this.setB("chainCaseSensitive",this.chainCaseSensitive);this.setB("cipRule6Full",this.cipRule6Full);this.setI("bondingVersion",this.bondingVersion);this.setO("dataSeparator",this.dataSeparator);this.setB("debugScript",this.debugScript);this.setO("defaultAngleLabel",this.defaultAngleLabel);this.setF("defaultDrawArrowScale",this.defaultDrawArrowScale);this.setO("defaultDirectory",this.defaultDirectory);this.setO("defaultDistanceLabel",this.defaultDistanceLabel);
this.setO("defaultDropScript",this.defaultDropScript);this.setO("defaultLabelPDB",this.defaultLabelPDB);this.setO("defaultLabelXYZ",this.defaultLabelXYZ);this.setO("defaultLoadFilter",this.defaultLoadFilter);this.setO("defaultLoadScript",this.defaultLoadScript);this.setB("defaultStructureDSSP",this.defaultStructureDSSP);this.setO("defaultTorsionLabel",this.defaultTorsionLabel);this.setF("defaultTranslucent",this.defaultTranslucent);this.setI("delayMaximumMs",this.delayMaximumMs);this.setF("dipoleScale",
this.dipoleScale);this.setB("disablePopupMenu",this.disablePopupMenu);this.setB("displayCellParameters",this.displayCellParameters);this.setI("dotDensity",this.dotDensity);this.setI("dotScale",this.dotScale);this.setB("dotsSelectedOnly",this.dotsSelectedOnly);this.setB("dotSurface",this.dotSurface);this.setB("dragSelected",this.dragSelected);this.setB("drawHover",this.drawHover);this.setF("drawFontSize",this.drawFontSize);this.setB("drawPicking",this.drawPicking);this.setB("dsspCalculateHydrogenAlways",
this.dsspCalcHydrogen);this.setB("ellipsoidArcs",this.ellipsoidArcs);this.setB("ellipsoidArrows",this.ellipsoidArrows);this.setB("ellipsoidAxes",this.ellipsoidAxes);this.setF("ellipsoidAxisDiameter",this.ellipsoidAxisDiameter);this.setB("ellipsoidBall",this.ellipsoidBall);this.setI("ellipsoidDotCount",this.ellipsoidDotCount);this.setB("ellipsoidDots",this.ellipsoidDots);this.setB("ellipsoidFill",this.ellipsoidFill);this.setO("energyUnits",this.energyUnits);this.setF("exportScale",this.exportScale);
this.setB("fontScaling",this.fontScaling);this.setB("fontCaching",this.fontCaching);this.setB("forceAutoBond",this.forceAutoBond);this.setO("forceField",this.forceField);this.setB("fractionalRelative",this.fractionalRelative);this.setF("particleRadius",this.particleRadius);this.setB("greyscaleRendering",this.greyscaleRendering);this.setF("hbondsAngleMinimum",this.hbondsAngleMinimum);this.setF("hbondHXDistanceMaximum",this.hbondHXDistanceMaximum);this.setF("hbondsDistanceMaximum",this.hbondNODistanceMaximum);
this.setB("hbondsBackbone",this.hbondsBackbone);this.setB("hbondsRasmol",this.hbondsRasmol);this.setB("hbondsSolid",this.hbondsSolid);this.setI("helixStep",this.helixStep);this.setO("helpPath",this.helpPath);this.setI("hermiteLevel",this.hermiteLevel);this.setB("hideNameInPopup",this.hideNameInPopup);this.setB("hideNavigationPoint",this.hideNavigationPoint);this.setB("hiddenLinesDashed",this.hiddenLinesDashed);this.setB("highResolution",this.highResolutionFlag);this.setF("hoverDelay",this.hoverDelayMs/
1E3);this.setB("imageState",this.imageState);this.setI("infoFontSize",this.infoFontSize);this.setB("isosurfaceKey",this.isosurfaceKey);this.setB("isosurfacePropertySmoothing",this.isosurfacePropertySmoothing);this.setI("isosurfacePropertySmoothingPower",this.isosurfacePropertySmoothingPower);this.setB("jmolInJSpecView",this.jmolInJSpecView);this.setB("justifyMeasurements",this.justifyMeasurements);this.setB("legacyAutoBonding",this.legacyAutoBonding);this.setB("legacyHAddition",this.legacyHAddition);
this.setB("legacyJavaFloat",this.legacyJavaFloat);this.setF("loadAtomDataTolerance",this.loadAtomDataTolerance);this.setO("loadFormat",this.loadFormat);this.setO("loadLigandFormat",this.pdbLoadLigandFormat);this.setB("logCommands",this.logCommands);this.setB("logGestures",this.logGestures);this.setB("measureAllModels",this.measureAllModels);this.setB("measurementLabels",this.measurementLabels);this.setO("measurementUnits",this.measureDistanceUnits);this.setI("meshScale",this.meshScale);this.setB("messageStyleChime",
this.messageStyleChime);this.setF("minBondDistance",this.minBondDistance);this.setI("minPixelSelRadius",this.minPixelSelRadius);this.setI("minimizationSteps",this.minimizationSteps);this.setB("minimizationRefresh",this.minimizationRefresh);this.setB("minimizationSilent",this.minimizationSilent);this.setF("minimizationCriterion",this.minimizationCriterion);this.setB("modelKitMode",this.modelKitMode);this.setF("modulationScale",this.modulationScale);this.setB("monitorEnergy",this.monitorEnergy);this.setF("multipleBondRadiusFactor",
this.multipleBondRadiusFactor);this.setB("multipleBondBananas",this.multipleBondBananas);this.setF("multipleBondSpacing",this.multipleBondSpacing);this.setB("multiProcessor",this.multiProcessor&&1<JV.Viewer.nProcessors);this.setB("navigationMode",this.navigationMode);this.setB("navigationPeriodic",this.navigationPeriodic);this.setF("navigationSpeed",this.navigationSpeed);this.setB("nboCharges",this.nboCharges);this.setB("noDelay",this.noDelay);this.setO("nmrPredictFormat",this.nmrPredictFormat);this.setO("nmrUrlFormat",
this.nmrUrlFormat);this.setB("partialDots",this.partialDots);this.setB("pdbAddHydrogens",this.pdbAddHydrogens);this.setB("pdbGetHeader",this.pdbGetHeader);this.setB("pdbSequential",this.pdbSequential);this.setI("percentVdwAtom",this.percentVdwAtom);this.setI("pickingSpinRate",this.pickingSpinRate);this.setO("pickLabel",this.pickLabel);this.setI("platformSpeed",this.platformSpeed);this.setF("pointGroupLinearTolerance",this.pointGroupLinearTolerance);this.setF("pointGroupDistanceTolerance",this.pointGroupDistanceTolerance);
this.setB("preserveState",this.preserveState);this.setO("propertyColorScheme",this.propertyColorScheme);this.setO("quaternionFrame",this.quaternionFrame);this.setB("rangeSelected",this.rangeSelected);this.setI("repaintWaitMs",this.repaintWaitMs);this.setI("ribbonAspectRatio",this.ribbonAspectRatio);this.setB("ribbonBorder",this.ribbonBorder);this.setB("rocketBarrels",this.rocketBarrels);this.setB("saveProteinStructureState",this.saveProteinStructureState);this.setB("scriptqueue",this.useScriptQueue);
this.setB("selectAllModels",this.selectAllModels);this.setB("selectHetero",this.rasmolHeteroSetting);this.setB("selectHydrogen",this.rasmolHydrogenSetting);this.setF("sheetSmoothing",this.sheetSmoothing);this.setB("showHiddenSelectionHalos",this.showHiddenSelectionHalos);this.setB("showHydrogens",this.showHydrogens);this.setB("showKeyStrokes",this.showKeyStrokes);this.setB("showMeasurements",this.showMeasurements);this.setB("showModulationVectors",this.showModVecs);this.setB("showMultipleBonds",this.showMultipleBonds);
this.setB("showNavigationPointAlways",this.showNavigationPointAlways);this.setI("showScript",this.scriptDelay);this.setB("showtiming",this.showTiming);this.setB("slabByMolecule",this.slabByMolecule);this.setB("slabByAtom",this.slabByAtom);this.setB("smartAromatic",this.smartAromatic);this.setI("minimizationMaxAtoms",this.minimizationMaxAtoms);this.setI("smallMoleculeMaxAtoms",this.smallMoleculeMaxAtoms);this.setO("smilesUrlFormat",this.smilesUrlFormat);this.setO("macroDirectory",this.macroDirectory);
this.setO("nihResolverFormat",this.nihResolverFormat);this.setO("pubChemFormat",this.pubChemFormat);this.setB("showUnitCellDetails",this.showUnitCellDetails);this.setB("solventProbe",this.dotSolvent);this.setF("solventProbeRadius",this.solventProbeRadius);this.setB("ssbondsBackbone",this.ssbondsBackbone);this.setF("starWidth",this.starWidth);this.setB("statusReporting",this.statusReporting);this.setI("strandCount",this.strandCountForStrands);this.setI("strandCountForStrands",this.strandCountForStrands);
this.setI("strandCountForMeshRibbon",this.strandCountForMeshRibbon);this.setF("strutDefaultRadius",this.strutDefaultRadius);this.setF("strutLengthMaximum",this.strutLengthMaximum);this.setI("strutSpacing",this.strutSpacing);this.setB("strutsMultiple",this.strutsMultiple);this.setB("testFlag1",this.testFlag1);this.setB("testFlag2",this.testFlag2);this.setB("testFlag3",this.testFlag3);this.setB("testFlag4",this.testFlag4);this.setB("traceAlpha",this.traceAlpha);this.setB("translucent",this.translucent);
this.setB("twistedSheets",this.twistedSheets);this.setB("useMinimizationThread",this.useMinimizationThread);this.setB("useNumberLocalization",this.useNumberLocalization);this.setB("vectorsCentered",this.vectorsCentered);this.setF("vectorScale",this.vectorScale);this.setB("vectorSymmetry",this.vectorSymmetry);this.setI("vectorTrail",this.vectorTrail);this.setF("vibrationPeriod",this.vibrationPeriod);this.setF("vibrationScale",this.vibrationScale);this.setB("waitForMoveTo",this.waitForMoveTo);this.setB("wireframeRotation",
this.wireframeRotation);this.setI("zDepth",this.zDepth);this.setB("zeroBasedXyzRasmol",this.zeroBasedXyzRasmol);this.setB("zoomHeight",this.zoomHeight);this.setB("zoomLarge",this.zoomLarge);this.setI("zShadePower",this.zShadePower);this.setI("zSlab",this.zSlab)},"JV.Viewer,JV.GlobalSettings,~B");c(c$,"clear",function(){for(var a=this.htUserVariables.keySet().iterator();a.hasNext();){var b=a.next();("@"==b.charAt(0)||b.startsWith("site_"))&&a.remove()}this.vwr.setPicked(-1,!1);this.setI("_atomhovered",
-1);this.setO("_pickinfo","");this.setB("selectionhalos",!1);this.setB("hidenotselected",!1);this.setB("measurementlabels",this.measurementLabels=!0);this.setB("drawHover",this.drawHover=!1);this.vwr.stm.saveScene("DELETE",null)});c(c$,"setUnits",function(a){var b=this.measureDistanceUnits,c=this.energyUnits;a.equalsIgnoreCase("angstroms")?this.measureDistanceUnits="angstroms":a.equalsIgnoreCase("nanometers")||a.equalsIgnoreCase("nm")?this.measureDistanceUnits="nanometers":a.equalsIgnoreCase("picometers")||
a.equalsIgnoreCase("pm")?this.measureDistanceUnits="picometers":a.equalsIgnoreCase("bohr")||a.equalsIgnoreCase("au")?this.measureDistanceUnits="au":a.equalsIgnoreCase("vanderwaals")||a.equalsIgnoreCase("vdw")?this.measureDistanceUnits="vdw":a.toLowerCase().endsWith("hz")||a.toLowerCase().endsWith("khz")?this.measureDistanceUnits=a.toLowerCase():a.equalsIgnoreCase("kj")?this.energyUnits="kJ":a.equalsIgnoreCase("kcal")&&(this.energyUnits="kcal");b.equalsIgnoreCase(this.measureDistanceUnits)?c.equalsIgnoreCase(this.energyUnits)||
this.setO("energyUnits",this.energyUnits):this.setO("measurementUnits",this.measureDistanceUnits)},"~S");c(c$,"isJmolVariable",function(a){return"_"==a.charAt(0)||this.htNonbooleanParameterValues.containsKey(a=a.toLowerCase())||this.htBooleanParameterFlags.containsKey(a)||0<=JV.GlobalSettings.unreportedProperties.indexOf(";"+a+";")},"~S");c(c$,"resetValue",function(a,b){this.setO(a,null==b?"":b.getParameter(a,!0))},"~S,JV.GlobalSettings");c(c$,"setB",function(a,b){a=a.toLowerCase();this.htNonbooleanParameterValues.containsKey(a)||
this.htBooleanParameterFlags.put(a,b?Boolean.TRUE:Boolean.FALSE)},"~S,~B");c(c$,"setI",function(a,b){2147483647!=b&&this.setO(a,Integer.$valueOf(b))},"~S,~N");c(c$,"setF",function(a,b){Float.isNaN(b)||this.setO(a,Float.$valueOf(b))},"~S,~N");c(c$,"setO",function(a,b){a=a.toLowerCase();null==b||this.htBooleanParameterFlags.containsKey(a)||this.htNonbooleanParameterValues.put(a,b)},"~S,~O");c(c$,"removeParam",function(a){a=a.toLowerCase();this.htBooleanParameterFlags.containsKey(a)?(this.htBooleanParameterFlags.remove(a),
this.htPropertyFlagsRemoved.containsKey(a)||this.htPropertyFlagsRemoved.put(a,Boolean.FALSE)):this.htNonbooleanParameterValues.containsKey(a)&&this.htNonbooleanParameterValues.remove(a)},"~S");c(c$,"setUserVariable",function(a,b){null!=b&&(a=a.toLowerCase(),this.htUserVariables.put(a,b.setName(a)));return b},"~S,JS.SV");c(c$,"unsetUserVariable",function(a){a.equals("all")||a.equals("variables")?(this.htUserVariables.clear(),JU.Logger.info("all user-defined variables deleted")):this.htUserVariables.containsKey(a)&&
(JU.Logger.info("variable "+a+" deleted"),this.htUserVariables.remove(a))},"~S");c(c$,"removeUserVariable",function(a){this.htUserVariables.remove(a)},"~S");c(c$,"getUserVariable",function(a){if(null==a)return null;a=a.toLowerCase();return this.htUserVariables.get(a)},"~S");c(c$,"getParameterEscaped",function(a,b){a=a.toLowerCase();if(this.htNonbooleanParameterValues.containsKey(a)){var c=this.htNonbooleanParameterValues.get(a);return JV.StateManager.varClip(a,JU.Escape.e(c),b)}return this.htBooleanParameterFlags.containsKey(a)?
this.htBooleanParameterFlags.get(a).toString():this.htUserVariables.containsKey(a)?this.htUserVariables.get(a).escape():this.htPropertyFlagsRemoved.containsKey(a)?"false":"<not defined>"},"~S,~N");c(c$,"getParameter",function(a,b){var c=this.getParam(a,!1);return null==c&&b?"":c},"~S,~B");c(c$,"getAndSetNewVariable",function(a,b){if(null==a||0==a.length)a="x";var c=this.getParam(a,!0);return null==c&&b&&"_"!=a.charAt(0)?this.setUserVariable(a,JS.SV.newV(4,"")):JS.SV.getVariable(c)},"~S,~B");c(c$,
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"predefinedStatic",u(-1,"@amino _g>0 & _g<=23;@acidic asp,glu;@basic arg,his,lys;@charged acidic,basic;@negative acidic;@positive basic;@neutral amino&!(acidic,basic);@polar amino&!hydrophobic;@peptide protein&within(chain,monomer>1)&!within(chain,monomer>12);@cyclic his,phe,pro,trp,tyr;@acyclic amino&!cyclic;@aliphatic ala,gly,ile,leu,val;@aromatic his,phe,trp,tyr;@cystine within(group,(cys,cyx)&atomname=sg&connected((cys,cyx)&atomname=sg));@buried ala,cys,ile,leu,met,phe,trp,val;@surface amino&!buried;@hydrophobic ala,gly,ile,leu,met,phe,pro,trp,tyr,val;@mainchain backbone;@small ala,gly,ser;@medium asn,asp,cys,pro,thr,val;@large arg,glu,gln,his,ile,leu,lys,met,phe,trp,tyr;@c nucleic & ([C] or [DC] or within(group,_a=42));@g nucleic & ([G] or [DG] or within(group,_a=43));@cg c,g;@a nucleic & ([A] or [DA] or within(group,_a=44));@t nucleic & ([T] or [DT] or within(group,_a=45 | _a=49));@at a,t;@i nucleic & ([I] or [DI] or within(group,_a=46) & !g);@u nucleic & ([U] or [DU] or within(group,_a=47) & !t);@tu nucleic & within(group,_a=48);@ions _g>=46&_g<48;@alpha _a=2;@_bb protein&(_a>=1&_a<6|_a=64) | nucleic&(_a>=6&_a<14|_a>=73&&_a<=79||_a==99||_a=100);@backbone _bb | _H && connected(single, _bb);@spine protein&_a>=1&_a<4|nucleic&(_a>=6&_a<11|_a=13);@sidechain (protein,nucleic) & !backbone;@base nucleic & !backbone;@dynamic_flatring search('[a]');@nonmetal _H,_He,_B,_C,_N,_O,_F,_Ne,_Si,_P,_S,_Cl,_Ar,_As,_Se,_Br,_Kr,_Te,_I,_Xe,_At,_Rn;@metal !nonmetal && !_Xx;@alkaliMetal _Li,_Na,_K,_Rb,_Cs,_Fr;@alkalineEarth _Be,_Mg,_Ca,_Sr,_Ba,_Ra;@nobleGas _He,_Ne,_Ar,_Kr,_Xe,_Rn;@metalloid _B,_Si,_Ge,_As,_Sb,_Te;@transitionMetal elemno>=21&elemno<=30|elemno=57|elemno=89|elemno>=39&elemno<=48|elemno>=72&elemno<=80|elemno>=104&elemno<=112;@lanthanide elemno>57&elemno<=71;@actinide elemno>89&elemno<=103".split(";")),
"MODELKIT_ZAP_STRING","5\n\nC 0 0 0\nH .63 .63 .63\nH -.63 -.63 .63\nH -.63 .63 -.63\nH .63 -.63 -.63","MODELKIT_ZAP_TITLE","Jmol Model Kit","ZAP_TITLE","zapped","ADD_HYDROGEN_TITLE","Viewer.AddHydrogens","DEFAULT_FONTFACE","SansSerif","DEFAULT_FONTSTYLE","Plain","MEASURE_DEFAULT_FONTSIZE",18,"AXES_DEFAULT_FONTSIZE",16,"SHAPE_BALLS",0,"SHAPE_STICKS",1,"SHAPE_HSTICKS",2,"SHAPE_SSSTICKS",3,"SHAPE_STRUTS",4,"SHAPE_LABELS",5,"SHAPE_MEASURES",6,"SHAPE_STARS",7,"SHAPE_MIN_HAS_SETVIS",8,"SHAPE_HALOS",8,
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c$.prototype.IMAGE_OR_SCENE=";jpg;jpeg;jpg64;jpeg64;gif;gift;pdf;ppm;png;pngj;pngt;scene;";E(c$,"LABEL_MINIMUM_FONTSIZE",6,"LABEL_MAXIMUM_FONTSIZE",63,"LABEL_DEFAULT_FONTSIZE",13,"LABEL_DEFAULT_X_OFFSET",4,"LABEL_DEFAULT_Y_OFFSET",4,"LABEL_OFFSET_MAX",500,"LABEL_OFFSET_MASK",1023,"LABEL_FLAGY_OFFSET_SHIFT",11,"LABEL_FLAGX_OFFSET_SHIFT",21,"LABEL_FLAGS",63,"LABEL_POINTER_FLAGS",3,"LABEL_POINTER_NONE",0,"LABEL_POINTER_ON",1,"LABEL_POINTER_BACKGROUND",2,"TEXT_ALIGN_SHIFT",2,"TEXT_ALIGN_FLAGS",12,"TEXT_ALIGN_NONE",
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3145728,"SMILES_GEN_BIO_COV_CROSSLINK",5242880,"SMILES_GEN_BIO_HH_CROSSLINK",9437184,"SMILES_GEN_BIO_COMMENT",17825792,"SMILES_GEN_BIO_NOCOMMENTS",34603008,"SMILES_GROUP_BY_MODEL",67108864,"SMILES_2D",134217728,"JSV_NOT",-1,"JSV_SEND_JDXMOL",0,"JSV_SETPEAKS",7,"JSV_SELECT",14,"JSV_STRUCTURE",21,"JSV_SEND_H1SIMULATE",28,"JSV_SEND_C13SIMULATE",35,"NBO_MODEL",42,"NBO_RUN",49,"NBO_VIEW",56,"NBO_SEARCH",63,"NBO_CONFIG",70,"JSV_CLOSE",77,"READER_NOT_FOUND","File reader was not found:","UNITID_MODEL",1,
"UNITID_RESIDUE",2,"UNITID_ATOM",4,"UNITID_INSCODE",8,"UNITID_TRIM",16,"DEFAULT_DRAG_DROP_SCRIPT","zap; load SYNC \"%FILE\";if (%ALLOWCARTOONS && _loadScript == '' && defaultLoadScript == '' && _filetype == 'Pdb') {if ({(protein or nucleic)&*/1.1} && {*/1.1}[1].groupindex != {*/1.1}[0].groupindex){select protein or nucleic;cartoons only;}if ({visible && cartoons > 0}){color structure}else{wireframe -0.1};if (!{visible}){spacefill 23%};select *}")});s("JV");v(["java.io.IOException"],"JV.JmolAsyncException",
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h,c,g,e?this.modelSet:null,f));0==this.modelSet.ac&&!this.modelSet.getMSInfoB("isPyMOL")&&this.zap()},"~S,~S,JU.SB,~O,JU.BS,~B");c$.reduceFilename=c(c$,"reduceFilename",function(a){if(null==a)return null;var b=a.indexOf(".");0<b&&(a=a.substring(0,b));24<a.length&&(a=a.substring(0,20)+" ...");return a},"~S");c(c$,"createAtomDataSet",function(a,b){return JM.ModelLoader.createAtomDataSet(this.vwr,this.modelSet,b,a,this.vwr.bsA())},"~O,~N")});s("JV");c$=t(function(){this.y=this.x=-1E3;this.modifiers=
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[];this.bsHidden=new JU.BS;this.bsSelection=new JU.BS;this.bsFixed=new JU.BS;this.bsTemp=new JU.BS});q(c$,function(a){this.vwr=a},"JV.Viewer");c(c$,"processDeletedModelAtoms",function(a){JU.BSUtil.deleteBits(this.bsDeleted,a);JU.BSUtil.deleteBits(this.bsSubset,a);JU.BSUtil.deleteBits(this.bsFixed,a);JU.BSUtil.deleteBits(this.bsHidden,a);var b=JU.BSUtil.copy(this.bsSelection);JU.BSUtil.deleteBits(b,a);this.setSelectionSet(b,0);this.selectionChanged(!1)},"JU.BS");c(c$,"clear",function(){this.clearSelection(!0);
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this.bsDeleted);a.setBsHidden(this.bsHidden);g||this.vwr.reportSelection(J.i18n.GT.i(J.i18n.GT.$("{0} atoms hidden"),this.bsHidden.cardinality()))},"JM.ModelSet,JU.BS,~N,~B");c(c$,"hide",function(a,b,c,g){var f=0==c||null==this.bsSubset?null:JU.BSUtil.andNot(JU.BSUtil.copy(this.bsHidden),this.bsSubset);JV.SelectionManager.setBitSet(this.bsHidden,b,c);null!=f&&this.bsHidden.or(f);null!=a&&a.setBsHidden(this.bsHidden);g||this.vwr.reportSelection(J.i18n.GT.i(J.i18n.GT.$("{0} atoms hidden"),this.bsHidden.cardinality()))},
"JM.ModelSet,JU.BS,~N,~B");c(c$,"setSelectionSet",function(a,b){JV.SelectionManager.setBitSet(this.bsSelection,a,b);this.empty=-1},"JU.BS,~N");c$.setBitSet=c(c$,"setBitSet",function(a,b,c){switch(c){default:a.clearAll();case 1275069441:null!=b&&a.or(b);break;case 1073742119:null!=b&&a.andNot(b)}},"JU.BS,JU.BS,~N");c(c$,"getHiddenSet",function(){return this.bsHidden});c(c$,"getHideNotSelected",function(){return this.hideNotSelected});c(c$,"setHideNotSelected",function(a){(this.hideNotSelected=a)&&
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c||this.vwr.reportSelection(J.i18n.GT.i(J.i18n.GT.$("{0} atoms selected"),b))},"JU.BS,~N,~B");c(c$,"selectAll",function(a){var b=this.vwr.ms.ac;for(this.empty=0==b?1:0;0<=--b;)this.bsSelection.set(b);JU.BSUtil.andNot(this.bsSelection,this.bsDeleted);this.selectionChanged(a)},"~B");c(c$,"clearSelection",function(a){this.setHideNotSelected(!1);this.bsSelection.clearAll();this.empty=1;this.selectionChanged(a)},"~B");c(c$,"isAtomSelected",function(a){return((null==this.bsSubset||this.bsSubset.get(a))&&
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this.listeners.length;0<=--b;)if(this.listeners[b]===a){this.listeners[b]=null;break}for(var c=this.listeners.length,b=c;0<=--b;)if(null==this.listeners[b]){this.listeners[b]=a;return}this.listeners=0==this.listeners.length?Array(1):JU.AU.doubleLength(this.listeners);this.listeners[c]=a},"J.api.JmolSelectionListener");c(c$,"selectionChanged",function(a){this.hideNotSelected&&this.hide(this.vwr.ms,JU.BSUtil.copyInvert(this.bsSelection,this.vwr.ms.ac),0,a);if(!(a||0==this.listeners.length))for(a=this.listeners.length;0<=
--a;)null!=this.listeners[a]&&this.listeners[a].selectionChanged(this.bsSelection)},"~B");c(c$,"deleteAtoms",function(a){var b=JU.BSUtil.copy(a);null==this.bsDeleted?this.bsDeleted=b:(b.andNot(this.bsDeleted),this.bsDeleted.or(a));this.bsHidden.andNot(this.bsDeleted);this.bsSelection.andNot(this.bsDeleted);return b.cardinality()},"JU.BS");c(c$,"getSelectedAtoms",function(){if(null==this.bsSubset)return this.bsSelection;var a=JU.BSUtil.copy(this.bsSelection);a.and(this.bsSubset);return a});c(c$,"getSelectedAtomsNoSubset",
function(){return JU.BSUtil.copy(this.bsSelection)});c(c$,"excludeAtoms",function(a,b){null!=this.bsDeleted&&a.andNot(this.bsDeleted);!b&&null!=this.bsSubset&&(a=JU.BSUtil.copy(a)).and(this.bsSubset);return a},"JU.BS,~B");c(c$,"setMotionFixedAtoms",function(a){this.bsFixed.clearAll();null!=a&&this.bsFixed.or(a)},"JU.BS");c(c$,"getMotionFixedAtoms",function(){return this.bsFixed});E(c$,"TRUE",1,"FALSE",0,"UNKNOWN",-1)});s("JV");v(null,"JV.ShapeManager","java.lang.Boolean JU.BS $.P3 J.api.Interface J.c.PAL $.VDW JM.Atom JU.BSUtil JV.JC".split(" "),
function(){c$=t(function(){this.navMinMax=this.bsSlabbedInternal=this.bsRenderableAtoms=this.vwr=this.shapes=this.ms=null;p(this,arguments)},JV,"ShapeManager");O(c$,function(){this.navMinMax=B(4,0)});q(c$,function(a){this.vwr=a;this.bsRenderableAtoms=new JU.BS;this.bsSlabbedInternal=new JU.BS},"JV.Viewer");c(c$,"findNearestShapeAtomIndex",function(a,b,c,g){if(null!=this.shapes)for(var f=0;f<this.shapes.length&&null==c[0];++f)null!=this.shapes[f]&&this.shapes[f].findNearestAtomIndex(a,b,c,g)},"~N,~N,~A,JU.BS");
c(c$,"getShapePropertyIndex",function(a,b,c){if(null==this.shapes||null==this.shapes[a])return null;this.vwr.setShapeErrorState(a,"get "+b);a=this.shapes[a].getProperty(b,c);this.vwr.setShapeErrorState(-1,null);return a},"~N,~S,~N");c(c$,"getShapePropertyData",function(a,b,c){if(null==this.shapes||null==this.shapes[a])return!1;this.vwr.setShapeErrorState(a,"get "+b);a=this.shapes[a].getPropertyData(b,c);this.vwr.setShapeErrorState(-1,null);return a},"~N,~S,~A");c(c$,"getShapeIdFromObjectName",function(a){if(null!=
this.shapes)for(var b=16;30>b;++b)if(null!=this.shapes[b]&&0<=this.shapes[b].getIndexFromName(a))return b;return null!=this.shapes[6]&&0<=this.shapes[6].getIndexFromName(a)?6:-1},"~S");c(c$,"loadDefaultShapes",function(a){this.ms=a;if(null!=this.shapes)for(var b=0;b<this.shapes.length;++b)null!=this.shapes[b]&&this.shapes[b].setModelSet(a);this.loadShape(0);this.loadShape(1)},"JM.ModelSet");c(c$,"loadShape",function(a){if(null==this.shapes)return null;if(null!=this.shapes[a])return this.shapes[a];
if(2==a||3==a||4==a)return null;var b=JV.JC.getShapeClassName(a,!1);if(null==(b=J.api.Interface.getInterface(b,this.vwr,"shape")))return null;this.vwr.setShapeErrorState(a,"allocate");b.initializeShape(this.vwr,this.ms,a);this.vwr.setShapeErrorState(-1,null);return this.shapes[a]=b},"~N");c(c$,"notifyAtomPositionsChanged",function(a,b,c){var g=Integer.$valueOf(a);a=this.vwr.getModelUndeletedAtomsBitSet(a);for(var f=0;37>f;f++)null!=this.shapes[f]&&this.setShapePropertyBs(f,"refreshTrajectories",u(-1,
[g,b,c]),a)},"~N,JU.BS,JU.M4");c(c$,"releaseShape",function(a){null!=this.shapes&&(this.shapes[a]=null)},"~N");c(c$,"resetShapes",function(){this.shapes=Array(37)});c(c$,"setShapeSizeBs",function(a,b,c,g){if(null!=this.shapes){if(null==g&&(1!=a||2147483647!=b))g=this.vwr.bsA();null!=c&&(0!=c.value&&c.vdwType===J.c.VDW.TEMP)&&this.ms.getBfactor100Lo();this.vwr.setShapeErrorState(a,"set size");(null==c?0!=b:0!=c.value)&&this.loadShape(a);null!=this.shapes[a]&&this.shapes[a].setShapeSizeRD(b,c,g);this.vwr.setShapeErrorState(-1,
null)}},"~N,~N,J.atomdata.RadiusData,JU.BS");c(c$,"setLabel",function(a,b){if(null==a){if(null==this.shapes[5])return}else this.loadShape(5),this.setShapeSizeBs(5,0,null,b);this.setShapePropertyBs(5,"label",a,b)},"~O,JU.BS");c(c$,"setShapePropertyBs",function(a,b,c,g){null==this.shapes||null==this.shapes[a]||(null==g&&(g=this.vwr.bsA()),this.vwr.setShapeErrorState(a,"set "+b),this.shapes[a].setProperty(b.intern(),c,g),this.vwr.setShapeErrorState(-1,null))},"~N,~S,~O,JU.BS");c(c$,"checkFrankclicked",
function(a,b){var c=this.shapes[36];return null!=c&&c.wasClicked(a,b)},"~N,~N");c(c$,"checkObjectClicked",function(a,b,c,g,f){var e,h=null;if(2==this.vwr.getPickingMode())return this.shapes[5].checkObjectClicked(a,b,c,g,!1);if(0!=c&&this.vwr.getBondsPickable()&&null!=(h=this.shapes[1].checkObjectClicked(a,b,c,g,!1)))return h;for(var j=0;j<JV.ShapeManager.clickableMax;j++)if(null!=(e=this.shapes[JV.ShapeManager.hoverable[j]])&&null!=(h=e.checkObjectClicked(a,b,c,g,f)))return h;return null},"~N,~N,~N,JU.BS,~B");
c(c$,"checkObjectDragged",function(a,b,c,g,f,e,h){for(var j=!1,l=0<h?h+1:37;!j&&h<l;++h)null!=this.shapes[h]&&(j=this.shapes[h].checkObjectDragged(a,b,c,g,f,e));return j},"~N,~N,~N,~N,~N,JU.BS,~N");c(c$,"checkObjectHovered",function(a,b,c,g){var f=this.shapes[1];if(g&&null!=f&&f.checkObjectHovered(a,b,c))return!0;for(g=0;g<JV.ShapeManager.hoverable.length;g++)if(f=this.shapes[JV.ShapeManager.hoverable[g]],null!=f&&f.checkObjectHovered(a,b,c))return!0;return!1},"~N,~N,JU.BS,~B");c(c$,"deleteShapeAtoms",
function(a,b){if(null!=this.shapes)for(var c=0;37>c;c++)null!=this.shapes[c]&&this.setShapePropertyBs(c,"deleteModelAtoms",a,b)},"~A,JU.BS");c(c$,"deleteVdwDependentShapes",function(a){null==a&&(a=this.vwr.bsA());null!=this.shapes[24]&&this.shapes[24].setProperty("deleteVdw",null,a);null!=this.shapes[25]&&this.shapes[25].setProperty("deleteVdw",null,a)},"JU.BS");c(c$,"getAtomShapeValue",function(a,b,c){a=JV.JC.shapeTokenIndex(a);if(0>a||null==this.shapes[a])return 0;c=this.shapes[a].getSize(c);if(0==
c){if(0==(b.shapeVisibilityFlags&this.shapes[a].vf))return 0;c=this.shapes[a].getSizeG(b)}return c/2E3},"~N,JM.Group,~N");c(c$,"replaceGroup",function(a,b){if(null!=this.shapes)for(var c=9;16>c;c++)null!=this.shapes[c]&&this.shapes[c].replaceGroup(a,b)},"JM.Group,JM.Group");c(c$,"getObjectMap",function(a,b){if(null!=this.shapes)for(var c=Boolean.$valueOf(b),g=16;30>g;++g)this.getShapePropertyData(g,"getNames",u(-1,[a,c]))},"java.util.Map,~B");c(c$,"getProperty",function(a){return a.equals("getShapes")?
this.shapes:null},"~O");c(c$,"getShape",function(a){return null==this.shapes?null:this.shapes[a]},"~N");c(c$,"resetBioshapes",function(a){if(null!=this.shapes)for(var b=0;b<this.shapes.length;++b)null!=this.shapes[b]&&this.shapes[b].isBioShape&&(this.shapes[b].setModelSet(this.ms),this.shapes[b].setShapeSizeRD(0,null,a),this.shapes[b].setProperty("color",J.c.PAL.NONE,a))},"JU.BS");c(c$,"setAtomLabel",function(a,b){null!=this.shapes&&this.shapes[5].setProperty("label:"+a,Integer.$valueOf(b),null)},
"~S,~N");c(c$,"setModelVisibility",function(){var a=this.shapes;if(!(null==a||null==a[0])){for(var b=this.vwr.getVisibleFramesBitSet(),c=8;33>c;c++)null!=a[c]&&a[c].setModelVisibilityFlags(b);var a=this.vwr.getBoolean(603979922),g=this.vwr.slm.bsDeleted,f=this.ms.at;this.ms.clearVisibleSets();if(0<f.length)for(c=this.ms.ac;0<=--c;){var e=f[c];null!=e&&(e.shapeVisibilityFlags&=-64);if(!(null!=g&&g.get(c))&&b.get(e.mi)){var h=1;if(!this.ms.isAtomHidden(c)&&(a||1!=e.getElementNumber()))h|=8,0!=e.madAtom&&
(h|=16),e.setShapeVisibility(h,!0)}}this.setShapeVis()}});c(c$,"setShapeVis",function(){for(var a=0;37>a;++a){var b=this.shapes[a];null!=b&&b.setAtomClickability()}});c(c$,"finalizeAtoms",function(a,b){var c=this.vwr,g=c.tm;b&&c.finalizeTransformParameters();if(null!=a){var f=this.ms.getAtomSetCenter(a),e=new JU.P3;g.transformPt3f(f,e);e.add(g.ptOffset);g.unTransformPoint(e,e);e.sub(f);c.setAtomCoordsRelative(e,a);g.ptOffset.set(0,0,0);g.bsSelectedAtoms=null}f=this.bsRenderableAtoms;this.ms.getAtomsInFrame(f);
var h=this.ms.vibrations,j=null!=h&&g.vibrationOn,l=null!=this.ms.bsModulated&&null!=this.ms.occupancies,n=this.ms.at,m,r=!1,p=this.bsSlabbedInternal;p.clearAll();for(var q=f.nextSetBit(0);0<=q;q=f.nextSetBit(q+1)){var e=n[q],s=j&&e.hasVibration()?g.transformPtVib(e,h[q]):g.transformPt(e);1==s.z&&(g.internalSlab&&g.xyzIsSlabbedInternal(e))&&p.set(q);e.sX=s.x;e.sY=s.y;e.sZ=s.z;var t=Math.abs(e.madAtom);t==JM.Atom.MAD_GLOBAL&&(t=A(2E3*c.getFloat(1140850689)));e.sD=$(c.tm.scaleToScreen(s.z,t));if(l&&
null!=h[q]&&-2147483648!=(m=h[q].getOccupancy100(j)))r=!0,e.setShapeVisibility(2,!1),0<=m&&50>m?e.setShapeVisibility(24,!1):e.setShapeVisibility(8|(0<e.madAtom?16:0),!0),this.ms.occupancies[e.i]=Math.abs(m)}r&&this.setShapeVis();m=c.gdata;if(g.slabEnabled){q=c.getBoolean(603979940);g=c.getBoolean(603979939);h=m.slab;j=m.depth;if(q){l=this.ms.getMolecules();r=this.ms.getMoleculeCountInModel(-1);for(q=0;q<r;q++)if(p=l[q],s=0,e=p.firstAtomIndex,f.get(e)){for(;s<p.ac&&!m.isClippedZ(n[e].sZ-(n[e].sD>>
1));s++,e++);if(s!=p.ac){e=p.firstAtomIndex;for(s=0;s<p.ac;s++)f.clear(e),n[e++].sZ=0}}}for(q=f.nextSetBit(0);0<=q;q=f.nextSetBit(q+1))if(e=n[q],m.isClippedZ(e.sZ-(g?n[q].sD>>1:0)))e.setClickable(0),l=w((g?-1:1)*e.sD/2),(e.sZ+l<h||e.sZ-l>j||!m.isInDisplayRange(e.sX,e.sY))&&f.clear(q)}if(0==this.ms.ac||!c.getShowNavigationPoint())return null;c=2147483647;m=-2147483648;g=2147483647;h=-2147483648;for(q=f.nextSetBit(0);0<=q;q=f.nextSetBit(q+1))e=n[q],e.sX<c&&(c=e.sX),e.sX>m&&(m=e.sX),e.sY<g&&(g=e.sY),
e.sY>h&&(h=e.sY);this.navMinMax[0]=c;this.navMinMax[1]=m;this.navMinMax[2]=g;this.navMinMax[3]=h;return this.navMinMax},"JU.BS,~B");c(c$,"setModelSet",function(a){this.ms=this.vwr.ms=a},"JM.ModelSet");c(c$,"checkInheritedShapes",function(){null!=this.shapes[24]&&this.setShapePropertyBs(24,"remapInherited",null,null)});c(c$,"restrictSelected",function(a,b){var c=this.vwr.slm.getSelectedAtomsNoSubset();if(b){this.vwr.slm.invertSelection();var g=this.vwr.slm.bsSubset;null!=g&&(c=this.vwr.slm.getSelectedAtomsNoSubset(),
c.and(g),this.vwr.select(c,!1,0,!0),JU.BSUtil.invertInPlace(c,this.vwr.ms.ac),c.and(g))}JU.BSUtil.andNot(c,this.vwr.slm.bsDeleted);g=this.vwr.getBoolean(603979812);a||this.vwr.setBooleanProperty("bondModeOr",!0);this.setShapeSizeBs(1,0,null,null);this.setShapePropertyBs(1,"type",Integer.$valueOf(32768),null);this.setShapeSizeBs(1,0,null,null);this.setShapePropertyBs(1,"type",Integer.$valueOf(1023),null);for(var f=this.vwr.bsA(),e=21;0<=--e;)6!=e&&null!=this.getShape(e)&&this.setShapeSizeBs(e,0,null,
f);null!=this.getShape(21)&&this.setShapePropertyBs(21,"off",f,null);this.setLabel(null,f);a||this.vwr.setBooleanProperty("bondModeOr",g);this.vwr.select(c,!1,0,!0)},"~B,~B");E(c$,"hoverable",B(-1,[31,20,25,24,22,36]));c$.clickableMax=c$.prototype.clickableMax=JV.ShapeManager.hoverable.length-1});s("JV");v(["java.util.Hashtable"],["JV.Connection","$.Scene","$.StateManager","$.Connections"],["java.util.Arrays","JU.BS","$.SB","JM.Orientation","JU.BSUtil"],function(){c$=t(function(){this.saved=this.vwr=
null;this.lastCoordinates=this.lastShape=this.lastState=this.lastSelected=this.lastScene=this.lastConnections=this.lastContext=this.lastOrientation="";p(this,arguments)},JV,"StateManager");O(c$,function(){this.saved=new java.util.Hashtable});c$.getVariableList=c(c$,"getVariableList",function(a,b,c,g){var f=new JU.SB,e=0,h=Array(a.size()),j;for(a=a.entrySet().iterator();a.hasNext()&&((j=a.next())||1);){var l=j.getKey(),n=j.getValue();if((c||!l.startsWith("site_"))&&(!g||"@"==l.charAt(0)))h[e++]=l+
("@"==l.charAt(0)?" "+n.asString():" = "+JV.StateManager.varClip(l,n.escape(),b))}java.util.Arrays.sort(h,0,e);for(b=0;b<e;b++)null!=h[b]&&f.append("  ").append(h[b]).append(";\n");0==e&&!g&&f.append("# --no global user variables defined--;\n");return f.toString()},"java.util.Map,~N,~B,~B");c$.getObjectIdFromName=c(c$,"getObjectIdFromName",function(a){if(null==a)return-1;a="background axis1      axis2      axis3      boundbox   unitcell   frank      ".indexOf(a.toLowerCase());return 0>a?a:w(a/11)},
"~S");c$.getObjectNameFromId=c(c$,"getObjectNameFromId",function(a){return 0>a||7<=a?null:"background axis1      axis2      axis3      boundbox   unitcell   frank      ".substring(11*a,11*a+11).trim()},"~N");q(c$,function(a){this.vwr=a},"JV.Viewer");c(c$,"clear",function(a){this.vwr.setShowAxes(!1);this.vwr.setShowBbcage(!1);this.vwr.setShowUnitCell(!1);a.clear()},"JV.GlobalSettings");c(c$,"resetLighting",function(){this.vwr.setIntProperty("ambientPercent",45);this.vwr.setIntProperty("celShadingPower",
10);this.vwr.setIntProperty("diffusePercent",84);this.vwr.setIntProperty("phongExponent",64);this.vwr.setIntProperty("specularExponent",6);this.vwr.setIntProperty("specularPercent",22);this.vwr.setIntProperty("specularPower",40);this.vwr.setIntProperty("zDepth",0);this.vwr.setIntProperty("zShadePower",3);this.vwr.setIntProperty("zSlab",50);this.vwr.setBooleanProperty("specular",!0);this.vwr.setBooleanProperty("celShading",!1);this.vwr.setBooleanProperty("zshade",!1)});c(c$,"setCrystallographicDefaults",
function(){this.vwr.setAxesMode(603979808);this.vwr.setShowAxes(!0);this.vwr.setShowUnitCell(!0);this.vwr.setBooleanProperty("perspectiveDepth",!1)});c(c$,"setCommonDefaults",function(){this.vwr.setBooleanProperty("perspectiveDepth",!0);this.vwr.setFloatProperty("bondTolerance",0.45);this.vwr.setFloatProperty("minBondDistance",0.4);this.vwr.setIntProperty("bondingVersion",0);this.vwr.setBooleanProperty("translucent",!0)});c(c$,"setJmolDefaults",function(){this.setCommonDefaults();this.vwr.setStringProperty("defaultColorScheme",
"Jmol");this.vwr.setBooleanProperty("axesOrientationRasmol",!1);this.vwr.setBooleanProperty("zeroBasedXyzRasmol",!1);this.vwr.setIntProperty("percentVdwAtom",23);this.vwr.setIntProperty("bondRadiusMilliAngstroms",150);this.vwr.setVdwStr("auto")});c(c$,"setRasMolDefaults",function(){this.setCommonDefaults();this.vwr.setStringProperty("defaultColorScheme","RasMol");this.vwr.setBooleanProperty("axesOrientationRasmol",!0);this.vwr.setBooleanProperty("zeroBasedXyzRasmol",!0);this.vwr.setIntProperty("percentVdwAtom",
0);this.vwr.setIntProperty("bondRadiusMilliAngstroms",1);this.vwr.setVdwStr("Rasmol")});c(c$,"setPyMOLDefaults",function(){this.setCommonDefaults();this.vwr.setStringProperty("measurementUnits","ANGSTROMS");this.vwr.setBooleanProperty("zoomHeight",!0)});c$.getNoCase=c(c$,"getNoCase",function(a,b){for(var c,g=a.entrySet().iterator();g.hasNext()&&((c=g.next())||1);)if(c.getKey().equalsIgnoreCase(b))return c.getValue();return null},"java.util.Map,~S");c(c$,"listSavedStates",function(){for(var a="",b,
c=this.saved.keySet().iterator();c.hasNext()&&((b=c.next())||1);)a+="\n"+b;return a});c(c$,"deleteSavedType",function(a){for(var b=this.saved.keySet().iterator();b.hasNext();)b.next().startsWith(a)&&b.remove()},"~S");c(c$,"deleteSaved",function(a){for(var b=this.saved.keySet().iterator();b.hasNext();){var c=b.next();(c.startsWith(a)||c.endsWith("_"+a)&&c.indexOf("_")==c.lastIndexOf("_"+a))&&b.remove()}},"~S");c(c$,"saveSelection",function(a,b){a.equalsIgnoreCase("DELETE")?this.deleteSavedType("Selected_"):
(a=this.lastSelected="Selected_"+a,this.saved.put(a,JU.BSUtil.copy(b)))},"~S,JU.BS");c(c$,"restoreSelection",function(a){a=JV.StateManager.getNoCase(this.saved,0<a.length?"Selected_"+a:this.lastSelected);if(null==a)return this.vwr.select(new JU.BS,!1,0,!1),!1;this.vwr.select(a,!1,0,!1);return!0},"~S");c(c$,"saveState",function(a){a.equalsIgnoreCase("DELETE")?this.deleteSavedType("State_"):(a=this.lastState="State_"+a,this.saved.put(a,this.vwr.getStateInfo()))},"~S");c(c$,"getSavedState",function(a){a=
JV.StateManager.getNoCase(this.saved,0<a.length?"State_"+a:this.lastState);return null==a?"":a},"~S");c(c$,"saveStructure",function(a){a.equalsIgnoreCase("DELETE")?this.deleteSavedType("Shape_"):(a=this.lastShape="Shape_"+a,this.saved.put(a,this.vwr.getStructureState()))},"~S");c(c$,"getSavedStructure",function(a){a=JV.StateManager.getNoCase(this.saved,0<a.length?"Shape_"+a:this.lastShape);return null==a?"":a},"~S");c(c$,"saveCoordinates",function(a,b){a.equalsIgnoreCase("DELETE")?this.deleteSavedType("Coordinates_"):
(a=this.lastCoordinates="Coordinates_"+a,this.saved.put(a,this.vwr.getCoordinateState(b)))},"~S,JU.BS");c(c$,"getSavedCoordinates",function(a){a=JV.StateManager.getNoCase(this.saved,0<a.length?"Coordinates_"+a:this.lastCoordinates);return null==a?"":a},"~S");c(c$,"getOrientation",function(){return new JM.Orientation(this.vwr,!1,null)});c(c$,"getSavedOrientationText",function(a){var b;if(null!=a)return b=this.getOrientationFor(a),null==b?"":b.getMoveToText(!0);a=new JU.SB;for(var c=this.saved.entrySet().iterator();c.hasNext()&&
((b=c.next())||1);)b.getKey().startsWith("Orientation_")&&a.append(b.getValue().getMoveToText(!0));return a.toString()},"~S");c(c$,"saveScene",function(a,b){if(a.equalsIgnoreCase("DELETE"))this.deleteSavedType("Scene_");else{var c=new JV.Scene(b);c.saveName=this.lastScene="Scene_"+a;this.saved.put(c.saveName,c)}},"~S,java.util.Map");c(c$,"restoreScene",function(a,b){var c=JV.StateManager.getNoCase(this.saved,0<a.length?"Scene_"+a:this.lastScene);return null!=c&&c.restore(this.vwr,b)},"~S,~N");c(c$,
"saveOrientation",function(a,b){if(a.equalsIgnoreCase("DELETE"))this.deleteSavedType("Orientation_");else{var c=new JM.Orientation(this.vwr,a.equalsIgnoreCase("default"),b);c.saveName=this.lastOrientation="Orientation_"+a;this.saved.put(c.saveName,c)}},"~S,~A");c(c$,"restoreOrientation",function(a,b,c){a=this.getOrientationFor(a);return null!=a&&a.restore(b,c)},"~S,~N,~B");c(c$,"getOrientationFor",function(a){return JV.StateManager.getNoCase(this.saved,0<a.length?"Orientation_"+a:this.lastOrientation)},
"~S");c(c$,"saveContext",function(a,b){a.equalsIgnoreCase("DELETE")?this.deleteSavedType("Context_"):this.saved.put(this.lastContext="Context_"+a,b)},"~S,~O");c(c$,"getContext",function(a){return this.saved.get(0==a.length?this.lastContext:"Context_"+a)},"~S");c(c$,"saveBonds",function(a){if(a.equalsIgnoreCase("DELETE"))this.deleteSavedType("Bonds_");else{var b=new JV.Connections(this.vwr);b.saveName=this.lastConnections="Bonds_"+a;this.saved.put(b.saveName,b)}},"~S");c(c$,"restoreBonds",function(a){this.vwr.clearModelDependentObjects();
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c(c$,"setStatusModelKit",function(a){var b=1==a?"ON":"OFF";this.setStatusChanged("modelkit",a,b,!1);a=this.jmolScriptCallback(J.c.CBK.MODELKIT);this.notifyEnabled(J.c.CBK.MODELKIT)&&this.cbl.notifyCallback(J.c.CBK.MODELKIT,u(-1,[a,b]))},"~N");c(c$,"setStatusFrameChanged",function(a,b,c,g,f,e,h){if(null!=this.vwr.ms){var j=this.vwr.am.animationOn,l=j?-2-f:f;this.setStatusChanged("frameChanged",l,0<=f?this.vwr.getModelNumberDotted(f):"",!1);var n=this.jmolScriptCallback(J.c.CBK.ANIMFRAME);this.notifyEnabled(J.c.CBK.ANIMFRAME)&&
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"setScriptEcho",function(a,b){if(null!=a){this.setStatusChanged("scriptEcho",0,a,!1);var c=this.jmolScriptCallback(J.c.CBK.ECHO);this.notifyEnabled(J.c.CBK.ECHO)&&this.cbl.notifyCallback(J.c.CBK.ECHO,u(-1,[c,a,Integer.$valueOf(b?1:0)]))}},"~S,~B");c(c$,"setStatusMeasuring",function(a,b,c,g){this.setStatusChanged(a,b,c,!1);var f=null;a.equals("measureCompleted")?(JU.Logger.info("measurement["+b+"] = "+c),f=this.jmolScriptCallback(J.c.CBK.MEASURE)):a.equals("measurePicked")&&(this.setStatusChanged("measurePicked",
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"~A");c(c$,"doSync",function(){return this.isSynced&&this.drivingSync&&!this.syncDisabled});c(c$,"setSync",function(a){this.syncingMouse?null!=a&&this.syncSend(a,"*",0):this.syncingScripts||this.syncSend("!"+this.vwr.tm.getMoveToText(this.minSyncRepeatMs/1E3,!1),"*",0)},"~S");c(c$,"setSyncDriver",function(a){this.stereoSync&&4!=a&&(this.syncSend("SET_GRAPHICS_OFF","*",0),this.stereoSync=!1);switch(a){case 4:if(!this.syncDisabled)return;this.syncDisabled=!1;break;case 3:this.syncDisabled=!0;break;
case 5:this.stereoSync=this.isSynced=this.drivingSync=!0;break;case 1:this.isSynced=this.drivingSync=!0;break;case 2:this.drivingSync=!1;this.isSynced=!0;break;default:this.isSynced=this.drivingSync=!1}JU.Logger.debugging&&JU.Logger.debug(this.vwr.appletName+" sync mode="+a+"; synced? "+this.isSynced+"; driving? "+this.drivingSync+"; disabled? "+this.syncDisabled)},"~N");c(c$,"syncSend",function(a,b,c){return 0!=c||this.notifyEnabled(J.c.CBK.SYNC)?(a=u(-1,[null,a,b,Integer.$valueOf(c)]),null!=this.cbl&&
this.cbl.notifyCallback(J.c.CBK.SYNC,a),a[0]):null},"~S,~O,~N");c(c$,"modifySend",function(a,b,c,g){var f=this.jmolScriptCallback(J.c.CBK.STRUCTUREMODIFIED);this.notifyEnabled(J.c.CBK.STRUCTUREMODIFIED)&&this.cbl.notifyCallback(J.c.CBK.STRUCTUREMODIFIED,u(-1,[f,Integer.$valueOf(c),Integer.$valueOf(a),Integer.$valueOf(b),g]))},"~N,~N,~N,~S");c(c$,"processService",function(a){var b=a.get("service");if(null==b)return null;if(n(b,JS.SV)){var b=new java.util.Hashtable,c;for(a=a.entrySet().iterator();a.hasNext()&&
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c(c$,"dialogAsk",function(a,b,c){var g=a.equals("Save Image"),f=J.api.Interface.getOption("dialog.Dialog",this.vwr,"status");if(null==f)return null;f.setupUI(!1);g&&f.setImageInfo(this.qualityJPG,this.qualityPNG,this.imageType);a=f.getFileNameFromDialog(this.vwr,a,b);g&&null!=a&&(this.qualityJPG=f.getQuality("JPG"),this.qualityPNG=f.getQuality("PNG"),g=f.getType(),null!=c&&(c.put("qualityJPG",Integer.$valueOf(this.qualityJPG)),c.put("qualityPNG",Integer.$valueOf(this.qualityPNG)),null!=g&&c.put("dialogImageType",
g)),null!=g&&(this.imageType=g));return a},"~S,~S,java.util.Map");c(c$,"getJspecViewProperties",function(a){return null==this.jsl?null:this.jsl.getJSpecViewProperty(null==a||0==a.length?"":":"+a)},"~S");c(c$,"resizeInnerPanel",function(a,b){return null==this.jsl||a==this.vwr.getScreenWidth()&&b==this.vwr.getScreenHeight()?B(-1,[a,b]):this.jsl.resizeInnerPanel("preferredWidthHeight "+a+" "+b+";")},"~N,~N");c(c$,"resizeInnerPanelString",function(a){null!=this.jsl&&this.jsl.resizeInnerPanel(a)},"~S");
c(c$,"registerAudio",function(a,b){this.stopAudio(a);null==this.audios&&(this.audios=new java.util.Hashtable);null==b?this.audios.remove(a):this.audios.put(a,b.get("audioPlayer"))},"~S,java.util.Map");c(c$,"stopAudio",function(a){null!=this.audios&&(a=this.audios.get(a),null!=a&&a.action("kill"))},"~S");c(c$,"playAudio",function(a){if(this.vwr.getBoolean(603979797))try{var b=null==a?"close":a.get("action"),c=null==a?null:a.get("id");if(null!=b&&0<b.length){if(null==c||0==c.length){if(null==this.audios||
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a),g&&this.setSyncDriver(3),0!=a.indexOf("Mouse: ")){b=JV.JC.getServiceCommand(a);switch(b){case 70:case 42:case 49:case 56:case 63:this.syncSend(a,".",c);return;case 0:case 77:case 28:case 35:if(g)return;case 21:case 7:case 14:if(null==(a=this.vwr.getJSV().processSync(a,b)))return}this.vwr.evalStringQuietSync(a,!0,!1)}else this.mouseScript(a),g&&this.vwr.setSyncDriver(4)}},"~S,~S,~N");c(c$,"mouseScript",function(a){var b=JU.PT.getTokens(a),c=b[1];try{switch(c=(c.toLowerCase()+"...............").substring(0,
15),"zoombyfactor...zoomby.........rotatezby......rotatexyby.....translatexyby..rotatemolecule.spinxyby.......rotatearcball..".indexOf(c)){case 0:switch(b.length){case 3:this.vwr.zoomByFactor(JU.PT.parseFloat(b[2]),2147483647,2147483647);return;case 5:this.vwr.zoomByFactor(JU.PT.parseFloat(b[2]),JU.PT.parseInt(b[3]),JU.PT.parseInt(b[4]));return}break;case 15:switch(b.length){case 3:this.vwr.zoomBy(JU.PT.parseInt(b[2]));return}break;case 30:switch(b.length){case 3:this.vwr.rotateZBy(JU.PT.parseInt(b[2]),
2147483647,2147483647);return;case 5:this.vwr.rotateZBy(JU.PT.parseInt(b[2]),JU.PT.parseInt(b[3]),JU.PT.parseInt(b[4]))}break;case 45:this.vwr.rotateXYBy(JU.PT.parseFloat(b[2]),JU.PT.parseFloat(b[3]));return;case 60:this.vwr.translateXYBy(JU.PT.parseInt(b[2]),JU.PT.parseInt(b[3]));return;case 75:this.vwr.rotateSelected(JU.PT.parseFloat(b[2]),JU.PT.parseFloat(b[3]),null);return;case 90:this.vwr.spinXYBy(JU.PT.parseInt(b[2]),JU.PT.parseInt(b[3]),JU.PT.parseFloat(b[4]));return;case 105:this.vwr.rotateXYBy(JU.PT.parseInt(b[2]),
JU.PT.parseInt(b[3]));return}}catch(g){if(!H(g,Exception))throw g;}this.vwr.showString("error reading SYNC command: "+a,!1)},"~S");E(c$,"MAXIMUM_QUEUE_LENGTH",16,"SYNC_OFF",0,"SYNC_DRIVER",1,"SYNC_SLAVE",2,"SYNC_DISABLE",3,"SYNC_ENABLE",4,"SYNC_STEREO",5)});s("JV");v("JU.A4 $.M3 $.M4 $.P3 $.P3i $.V3 J.c.STER JU.Point3fi".split(" "),"JV.TransformManager","java.lang.Boolean $.Float java.util.Hashtable JU.P4 $.Quat $.SB J.api.Interface JU.Escape $.Logger".split(" "),function(){c$=t(function(){this.spinThread=
this.vibrationThread=this.movetoThread=this.vwr=null;this.perspectiveModel=11;this.modelRadiusPixels=this.modelRadius=this.modelCenterOffset=this.cameraDistanceFromCenter=this.aperatureAngle=this.referencePlaneOffset=this.cameraScaleFactor=0;this.navigationShiftXY=this.navigationOffset=this.navigationCenter=null;this.navigationDepthPercent=0;this.vectorTemp=this.matrixTemp=null;this.haveNotifiedNaN=!1;this.spinX=0;this.spinY=30;this.spinZ=0;this.spinFps=30;this.navZ=this.navY=this.navX=0;this.navFps=
NaN;this.doTransform4D=this.isSpinSelected=this.isSpinFixed=this.isSpinInternal=!1;this.rotationCenterDefault=this.perspectiveShiftXY=this.perspectiveOffset=this.fixedRotationCenter=this.fixedRotationOffset=null;this.rotationRadiusDefault=0;this.internalRotationCenter=this.internalTranslation=this.internalRotationAxis=this.fixedRotationAxis=null;this.internalRotationAngle=0;this.rotationAxis=this.pointT2=this.vectorT2=this.vectorT=this.axisangleT=this.matrixTemp4=this.matrixTemp3=this.matrixRotate=
null;this.rotationRate=0;this.cameraSetting=this.camera=this.fixedTranslation=null;this.yTranslationFraction=this.xTranslationFraction=0.5;this.previousY=this.previousX=this.prevZoomSetting=0;this.zoomEnabled=!0;this.zmPctSet=this.zmPct=100;this.zoomRatio=0;this.internalSlab=this.zShadeEnabled=this.slabEnabled=!1;this.depthValue=this.slabValue=this.depthPercentSetting=this.slabPercentSetting=0;this.zSlabPercentSetting=50;this.zDepthPercentSetting=0;this.zSlabPoint=null;this.slabRange=this.zDepthValue=
this.zSlabValue=0;this.depthPlane=this.slabPlane=null;this.perspectiveDepth=!0;this.scale3D=!1;this.cameraDepthSetting=this.cameraDepth=3;this.visualRangeAngstroms=0;this.cameraDistance=1E3;this.scale3DAngstromsPerInch=this.scaleDefaultPixelsPerAngstrom=this.scalePixelsPerAngstrom=this.screenPixelCount=this.height=this.width=0;this.zoomHeight=this.useZoomLarge=this.antialias=!1;this.screenHeight=this.screenWidth=0;this.ptVibTemp=this.iScrPt=this.fScrPt=this.matrixTransformInv=this.matrixTransform=
null;this.navigating=!1;this.defaultMode=this.mode=0;this.matrixTest=this.aaTest1=this.ptTest3=this.ptTest2=this.ptTest1=this.untransformedPoint=null;this.vibrationOn=this.spinIsGesture=this.navOn=this.spinOn=!1;this.vibrationScale=this.vibrationPeriodMs=this.vibrationPeriod=0;this.stereoColors=this.stereoMode=this.vibrationT=null;this.stereoDoubleFull=this.stereoDoubleDTI=!1;this.stereoDegrees=NaN;this.stereoRadians=0;this.stereoFrame=!1;this.matrixStereo=null;this.windowCentered=!1;this.ptOffset=
this.bsSelectedAtoms=this.bsFrameOffsets=this.frameOffsets=this.frameOffset=null;this.navMode=1;this.zoomFactor=3.4028235E38;this.navigationSlabOffset=0;this.nav=null;p(this,arguments)},JV,"TransformManager");O(c$,function(){this.navigationCenter=new JU.P3;this.navigationOffset=new JU.P3;this.navigationShiftXY=new JU.P3;this.matrixTemp=new JU.M4;this.vectorTemp=new JU.V3;this.fixedRotationOffset=new JU.P3;this.fixedRotationCenter=new JU.P3;this.perspectiveOffset=new JU.P3;this.perspectiveShiftXY=
new JU.P3;this.rotationCenterDefault=new JU.P3;this.fixedRotationAxis=new JU.A4;this.internalRotationAxis=new JU.A4;this.internalRotationCenter=JU.P3.new3(0,0,0);this.matrixRotate=new JU.M3;this.matrixTemp3=new JU.M3;this.matrixTemp4=new JU.M4;this.axisangleT=new JU.A4;this.vectorT=new JU.V3;this.vectorT2=new JU.V3;this.pointT2=new JU.P3;this.rotationAxis=new JU.V3;this.fixedTranslation=new JU.P3;this.camera=new JU.P3;this.cameraSetting=new JU.P3;this.matrixTransform=new JU.M4;this.matrixTransformInv=
new JU.M4;this.fScrPt=new JU.P3;this.iScrPt=new JU.P3i;this.ptVibTemp=new JU.Point3fi;this.untransformedPoint=new JU.P3;this.ptTest1=new JU.P3;this.ptTest2=new JU.P3;this.ptTest3=new JU.P3;this.aaTest1=new JU.A4;this.matrixTest=new JU.M3;this.vibrationT=new JU.P3;this.stereoMode=J.c.STER.NONE;this.matrixStereo=new JU.M3;this.frameOffset=new JU.P3;this.ptOffset=new JU.P3});q(c$,function(){});c$.getTransformManager=c(c$,"getTransformManager",function(a,b,c,g){g=g?J.api.Interface.getInterface("JV.TransformManager4D",
a,"tm"):new JV.TransformManager;g.vwr=a;g.setScreenParameters(b,c,!0,!1,!0,!0);return g},"JV.Viewer,~N,~N,~B");c(c$,"setDefaultPerspective",function(){this.setCameraDepthPercent(3,!0);this.setPerspectiveDepth(!0);this.setStereoDegrees(-5);this.visualRangeAngstroms=5;this.setSpinOff();this.setVibrationPeriod(0)});c(c$,"homePosition",function(a){a&&this.setSpinOff();this.setNavOn(!1);this.navFps=10;this.navX=this.navY=this.navZ=0;this.rotationCenterDefault.setT(this.vwr.getBoundBoxCenter());this.setFixedRotationCenter(this.rotationCenterDefault);
this.rotationRadiusDefault=this.setRotationRadius(0,!0);this.windowCentered=!0;this.setRotationCenterAndRadiusXYZ(null,!0);this.resetRotation();a=this.vwr.ms.getInfoM("defaultOrientationMatrix");null!=a&&this.setRotation(a);this.setZoomEnabled(!0);this.zoomToPercent(this.vwr.g.modelKitMode?50:100);this.zmPct=this.zmPctSet;this.slabReset();this.resetFitToScreen(!0);this.vwr.isJmolDataFrame()?this.fixedRotationCenter.set(0,0,0):this.vwr.g.axesOrientationRasmol&&this.matrixRotate.setAsXRotation(3.141592653589793);
this.vwr.stm.saveOrientation("default",null);1==this.mode&&this.setNavigationMode(!0)},"~B");c(c$,"setRotation",function(a){a.isRotation()?this.matrixRotate.setM3(a):this.resetRotation()},"JU.M3");c(c$,"resetRotation",function(){this.matrixRotate.setScale(1)});c(c$,"clearThreads",function(){this.clearVibration();this.clearSpin();this.setNavOn(!1);this.stopMotion()});c(c$,"clear",function(){this.fixedRotationCenter.set(0,0,0);this.navigating=!1;this.zSlabPoint=this.depthPlane=this.slabPlane=null;this.resetNavigationPoint(!0)});
c(c$,"setFixedRotationCenter",function(a){null!=a&&this.fixedRotationCenter.setT(a)},"JU.T3");c(c$,"setRotationPointXY",function(a){a=this.transformPt(a);this.fixedTranslation.set(a.x,a.y,0)},"JU.P3");c(c$,"spinXYBy",function(a,b,c){if(0==a&&0==b)null!=this.spinThread&&this.spinIsGesture&&this.clearSpin();else{this.clearSpin();var g=JU.P3.newP(this.fixedRotationCenter),f=new JU.P3;this.transformPt3f(g,f);a=JU.P3.new3(-b,a,0);a.add(f);this.unTransformPoint(a,a);this.vwr.setInMotion(!1);this.rotateAboutPointsInternal(null,
a,g,10*c,NaN,!1,!0,null,!0,null,null,null,null)}},"~N,~N,~N");c(c$,"rotateXYBy",function(a,b,c){this.rotate3DBall(a,b,c)},"~N,~N,JU.BS");c(c$,"rotateZBy",function(a,b,c){2147483647!=b&&2147483647!=c&&this.resetXYCenter(b,c);this.rotateZRadians(a/57.29577951308232)},"~N,~N,~N");c(c$,"applyRotation",function(a,b,c,g,f,e){null==c?this.matrixRotate.mul2(a,this.matrixRotate):(this.vwr.moveAtoms(e,a,this.matrixRotate,g,this.internalRotationCenter,b,c,f),null!=g&&this.internalRotationCenter.add(g))},"JU.M3,~B,JU.BS,JU.V3,~B,JU.M4");
c(c$,"rotate3DBall",function(a,b,c){this.matrixTemp3.setAsBallRotation(0.017453292,-b,-a)&&this.applyRotation(this.matrixTemp3,!1,c,null,!1,null)},"~N,~N,JU.BS");c(c$,"rotateXRadians",function(a,b){this.applyRotation(this.matrixTemp3.setAsXRotation(a),!1,b,null,!1,null)},"~N,JU.BS");c(c$,"rotateYRadians",function(a,b){this.applyRotation(this.matrixTemp3.setAsYRotation(a),!1,b,null,!1,null)},"~N,JU.BS");c(c$,"rotateZRadians",function(a){this.applyRotation(this.matrixTemp3.setAsZRotation(a),!1,null,
null,!1,null)},"~N");c(c$,"rotateAxisAngle",function(a,b){this.axisangleT.setVA(a,b);this.rotateAxisAngle2(this.axisangleT,null)},"JU.V3,~N");c(c$,"rotateAxisAngle2",function(a,b){this.applyRotation(this.matrixTemp3.setAA(a),!1,b,null,!1,null)},"JU.A4,JU.BS");c(c$,"rotateAxisAngleAtCenter",function(a,b,c,g,f,e,h){null!=b&&this.moveRotationCenter(b,!0);e&&this.setSpinOff();this.setNavOn(!1);if(this.vwr.headless){if(e&&3.4028235E38==f)return!1;e=!1}if(Float.isNaN(g)||0==g||0==f)return!1;null!=b&&this.setRotationPointXY(b);
this.setFixedRotationCenter(b);this.rotationAxis.setT(c);this.rotationRate=g;if(e)return this.fixedRotationAxis.setVA(c,0.017453292*g),this.isSpinInternal=!1,this.isSpinFixed=!0,this.isSpinSelected=null!=h,this.setSpin(a,!0,f,null,null,h,!1),3.4028235E38!=f;a=0.017453292*f;this.fixedRotationAxis.setVA(c,f);this.rotateAxisAngleRadiansFixed(a,h);return!0},"J.api.JmolScriptEvaluator,JU.P3,JU.V3,~N,~N,~B,JU.BS");c(c$,"rotateAxisAngleRadiansFixed",function(a,b){this.axisangleT.setAA(this.fixedRotationAxis);
this.axisangleT.angle=a;this.rotateAxisAngle2(this.axisangleT,b)},"~N,JU.BS");c(c$,"rotateAboutPointsInternal",function(a,b,c,g,f,e,h,j,l,n,m,r,p){h&&this.setSpinOff();this.setNavOn(!1);if(null==r&&(null==n||0.001>n.length())&&(h?Float.isNaN(g)||0==g:0==f))return!1;var q=null;null==r&&(q=JU.V3.newVsub(c,b),e&&q.scale(-1),this.internalRotationCenter.setT(b),this.rotationAxis.setT(q),this.internalTranslation=null==n?null:JU.V3.newV(n));b=null!=j;if(h)return null==r?(0==f&&(f=NaN),Float.isNaN(f)?this.rotationRate=
g:(p=w(Math.abs(f)/Math.abs(g)*this.spinFps+0.5),this.rotationRate=f/p*this.spinFps,null!=n&&this.internalTranslation.scale(1/p)),this.internalRotationAxis.setVA(q,0.017453292*(Float.isNaN(this.rotationRate)?0:this.rotationRate)),this.isSpinInternal=!0,this.isSpinFixed=!1,this.isSpinSelected=b):f=g,this.setSpin(a,!0,f,m,r,j,l),!Float.isNaN(f);a=0.017453292*f;this.internalRotationAxis.setVA(q,a);this.rotateAxisAngleRadiansInternal(a,j,p);return!1},"J.api.JmolScriptEvaluator,JU.T3,JU.T3,~N,~N,~B,~B,JU.BS,~B,JU.V3,JU.Lst,~A,JU.M4");
c(c$,"rotateAxisAngleRadiansInternal",function(a,b,c){this.internalRotationAngle=a;this.vectorT.set(this.internalRotationAxis.x,this.internalRotationAxis.y,this.internalRotationAxis.z);this.matrixRotate.rotate2(this.vectorT,this.vectorT2);this.axisangleT.setVA(this.vectorT2,a);this.applyRotation(this.matrixTemp3.setAA(this.axisangleT),!0,b,this.internalTranslation,1E6<a,c);null==b&&this.getNewFixedRotationCenter()},"~N,JU.BS,JU.M4");c(c$,"getNewFixedRotationCenter",function(){this.axisangleT.setAA(this.internalRotationAxis);
this.axisangleT.angle=-this.internalRotationAngle;this.matrixTemp4.setToAA(this.axisangleT);this.vectorT.setT(this.internalRotationCenter);this.pointT2.sub2(this.fixedRotationCenter,this.vectorT);var a=this.matrixTemp4.rotTrans2(this.pointT2,new JU.P3);a.add(this.vectorT);this.setRotationCenterAndRadiusXYZ(a,!1)});c(c$,"setTranslationFractions",function(){this.xTranslationFraction=this.fixedTranslation.x/this.width;this.yTranslationFraction=this.fixedTranslation.y/this.height});c(c$,"centerAt",function(a,
b,c){null==c?this.translateXYBy(a,b):(this.windowCentered&&this.vwr.setBooleanProperty("windowCentered",!1),this.fixedTranslation.x=a,this.fixedTranslation.y=b,this.setFixedRotationCenter(c))},"~N,~N,JU.P3");c(c$,"percentToPixels",function(a,b){switch(a){case "x":return w(Math.floor(b/100*this.width));case "y":return w(Math.floor(b/100*this.height));case "z":return w(Math.floor(b/100*this.screenPixelCount))}return 0},"~S,~N");c(c$,"angstromsToPixels",function(a){return w(Math.floor(this.scalePixelsPerAngstrom*
a))},"~N");c(c$,"translateXYBy",function(a,b){this.fixedTranslation.x+=a;this.fixedTranslation.y+=b;this.setTranslationFractions()},"~N,~N");c(c$,"setCamera",function(a,b){this.cameraSetting.set(a,b,0==a&&0==b?0:1)},"~N,~N");c(c$,"translateToPercent",function(a,b){switch(a){case "x":this.xTranslationFraction=0.5+b/100;this.fixedTranslation.x=this.width*this.xTranslationFraction;break;case "y":this.yTranslationFraction=0.5+b/100;this.fixedTranslation.y=this.height*this.yTranslationFraction;break;case "z":1==
this.mode&&this.setNavigationDepthPercent(b)}},"~S,~N");c(c$,"getTranslationXPercent",function(){return 0==this.width?0:100*(this.fixedTranslation.x-this.width/2)/this.width});c(c$,"getTranslationYPercent",function(){return 0==this.height?0:100*(this.fixedTranslation.y-this.height/2)/this.height});c(c$,"getTranslationScript",function(){var a="",b=this.getTranslationXPercent();0!=b&&(a+="translate x "+b+";");b=this.getTranslationYPercent();0!=b&&(a+="translate y "+b+";");return a});c(c$,"getOrientationText",
function(a,b){switch(a){case 4129:return this.getMoveToText(1,!1);case 1073742132:var c=this.getRotationQ();b&&(c=c.inv());return c.toString();case 1073742178:var c=new JU.SB,g=this.getTranslationXPercent();JV.TransformManager.truncate2(c,b?-g:g);g=this.getTranslationYPercent();JV.TransformManager.truncate2(c,b?-g:g);return c.toString();default:return this.getMoveToText(1,!0)+"\n#OR\n"+this.getRotateZyzText(!0)}},"~N,~B");c(c$,"getRotationQ",function(){return JU.Quat.newM(this.matrixRotate)});c(c$,
"getOrientationInfo",function(){var a=new java.util.Hashtable;a.put("moveTo",this.getMoveToText(1,!1));a.put("center","center "+this.getCenterText());a.put("centerPt",this.fixedRotationCenter);var b=new JU.A4;b.setM(this.matrixRotate);a.put("axisAngle",b);a.put("quaternion",this.getRotationQ().toPoint4f());a.put("rotationMatrix",this.matrixRotate);a.put("rotateZYZ",this.getRotateZyzText(!1));a.put("rotateXYZ",this.getRotateXyzText());a.put("transXPercent",Float.$valueOf(this.getTranslationXPercent()));
a.put("transYPercent",Float.$valueOf(this.getTranslationYPercent()));a.put("zoom",Float.$valueOf(this.zmPct));a.put("modelRadius",Float.$valueOf(this.modelRadius));1==this.mode&&(a.put("navigationCenter","navigate center "+JU.Escape.eP(this.navigationCenter)),a.put("navigationOffsetXPercent",Float.$valueOf(this.getNavigationOffsetPercent("X"))),a.put("navigationOffsetYPercent",Float.$valueOf(this.getNavigationOffsetPercent("Y"))),a.put("navigationDepthPercent",Float.$valueOf(this.navigationDepthPercent)));
return a});c(c$,"getRotation",function(a){a.setM3(this.matrixRotate)},"JU.M3");c(c$,"setZoomHeight",function(a,b){this.zoomHeight=a;this.scaleFitToScreen(!1,b,!1,!0)},"~B,~B");c(c$,"zoomBy",function(a){20<a?a=20:-20>a&&(a=-20);var b=a*this.zmPctSet/50;0==b&&(b=0<a?1:0>b?-1:0);this.zoomRatio=(b+this.zmPctSet)/this.zmPctSet;this.zmPctSet+=b},"~N");c(c$,"zoomByFactor",function(a,b,c){!(0>=a)&&this.zoomEnabled&&(1!=this.mode?(this.zoomRatio=a,this.zmPctSet*=a,this.resetXYCenter(b,c)):this.getNav()&&this.nav.zoomByFactor(a,
b,c))},"~N,~N,~N");c(c$,"zoomToPercent",function(a){this.zmPctSet=a;this.zoomRatio=0},"~N");c(c$,"translateZBy",function(a){a>=this.screenPixelCount||(a=this.scalePixelsPerAngstrom/(1-1*a/this.screenPixelCount),a>=this.screenPixelCount||(a=100*(a/this.scaleDefaultPixelsPerAngstrom),this.zoomRatio=a/this.zmPctSet,this.zmPctSet=a))},"~N");c(c$,"resetXYCenter",function(a,b){if(!(2147483647==a||2147483647==b)){this.windowCentered&&this.vwr.setBooleanProperty("windowCentered",!1);var c=new JU.P3;this.transformPt3f(this.fixedRotationCenter,
c);c.set(a,b,c.z);this.unTransformPoint(c,c);this.fixedTranslation.set(a,b,0);this.setFixedRotationCenter(c)}},"~N,~N");c(c$,"zoomByPercent",function(a){var b=a*this.zmPctSet/100;0==b&&(b=0>a?-1:1);this.zoomRatio=(b+this.zmPctSet)/this.zmPctSet;this.zmPctSet+=b},"~N");c(c$,"setScaleAngstromsPerInch",function(a){if(this.scale3D=0<a)this.scale3DAngstromsPerInch=a;this.perspectiveDepth=!this.scale3D},"~N");c(c$,"setSlabRange",function(a){this.slabRange=a},"~N");c(c$,"setSlabEnabled",function(a){this.vwr.g.setB("slabEnabled",
this.slabEnabled=a)},"~B");c(c$,"setZShadeEnabled",function(a){this.zShadeEnabled=a;this.vwr.g.setB("zShade",a)},"~B");c(c$,"setZoomEnabled",function(a){this.zoomEnabled=a;this.vwr.g.setB("zoomEnabled",a)},"~B");c(c$,"slabReset",function(){this.slabToPercent(100);this.depthToPercent(0);this.slabPlane=this.depthPlane=null;this.setSlabEnabled(!1);this.setZShadeEnabled(!1);this.slabDepthChanged()});c(c$,"getSlabPercentSetting",function(){return this.slabPercentSetting});c(c$,"slabDepthChanged",function(){this.vwr.g.setI("slab",
this.slabPercentSetting);this.vwr.g.setI("depth",this.depthPercentSetting);this.finalizeTransformParameters()});c(c$,"slabByPercentagePoints",function(a){this.slabPlane=null;if(!(0>a?this.slabPercentSetting<=Math.max(0,this.depthPercentSetting):100<=this.slabPercentSetting))this.slabPercentSetting+=a,this.slabDepthChanged(),this.depthPercentSetting>=this.slabPercentSetting&&(this.depthPercentSetting=this.slabPercentSetting-1)},"~N");c(c$,"depthByPercentagePoints",function(a){this.depthPlane=null;
if(!(0>a?0>=this.depthPercentSetting:this.depthPercentSetting>=Math.min(100,this.slabPercentSetting)))this.depthPercentSetting+=a,this.slabPercentSetting<=this.depthPercentSetting&&(this.slabPercentSetting=this.depthPercentSetting+1),this.slabDepthChanged()},"~N");c(c$,"slabDepthByPercentagePoints",function(a){this.depthPlane=this.slabPlane=null;if(!(0>a?this.slabPercentSetting<=Math.max(0,this.depthPercentSetting):this.depthPercentSetting>=Math.min(100,this.slabPercentSetting)))this.slabPercentSetting+=
a,this.depthPercentSetting+=a,this.slabDepthChanged()},"~N");c(c$,"slabToPercent",function(a){this.slabPlane=null;this.vwr.setFloatProperty("slabRange",0);this.slabPercentSetting=a;this.depthPercentSetting>=this.slabPercentSetting&&(this.depthPercentSetting=this.slabPercentSetting-1);this.slabDepthChanged()},"~N");c(c$,"depthToPercent",function(a){this.depthPlane=null;this.vwr.g.setI("depth",a);this.depthPercentSetting=a;this.slabPercentSetting<=this.depthPercentSetting&&(this.slabPercentSetting=
this.depthPercentSetting+1);this.slabDepthChanged()},"~N");c(c$,"zSlabToPercent",function(a){this.zSlabPercentSetting=a;this.zDepthPercentSetting>this.zSlabPercentSetting&&(this.zDepthPercentSetting=a)},"~N");c(c$,"zDepthToPercent",function(a){this.zDepthPercentSetting=a;this.zDepthPercentSetting>this.zSlabPercentSetting&&(this.zSlabPercentSetting=a)},"~N");c(c$,"slabInternal",function(a,b){b?(this.depthPlane=a,this.depthPercentSetting=0):(this.slabPlane=a,this.slabPercentSetting=100);this.slabDepthChanged()},
"JU.P4,~B");c(c$,"setSlabDepthInternal",function(a){a?this.depthPlane=null:this.slabPlane=null;this.finalizeTransformParameters();this.slabInternal(this.getSlabDepthPlane(a),a)},"~B");c(c$,"getSlabDepthPlane",function(a){if(a){if(null!=this.depthPlane)return this.depthPlane}else if(null!=this.slabPlane)return this.slabPlane;var b=this.matrixTransform;return JU.P4.new4(-b.m20,-b.m21,-b.m22,-b.m23+(a?this.depthValue:this.slabValue))},"~B");c(c$,"getCameraFactors",function(){this.aperatureAngle=360*
Math.atan2(this.screenPixelCount/2,this.referencePlaneOffset)/3.141592653589793;this.cameraDistanceFromCenter=this.referencePlaneOffset/this.scalePixelsPerAngstrom;var a=JU.P3.new3(w(this.screenWidth/2),w(this.screenHeight/2),this.referencePlaneOffset);this.unTransformPoint(a,a);var b=JU.P3.new3(w(this.screenWidth/2),w(this.screenHeight/2),0);this.unTransformPoint(b,b);b.sub(this.fixedRotationCenter);var c=JU.P3.new3(w(this.screenWidth/2),w(this.screenHeight/2),this.cameraDistanceFromCenter*this.scalePixelsPerAngstrom);
this.unTransformPoint(c,c);c.sub(this.fixedRotationCenter);b.add(c);return u(-1,[a,b,this.fixedRotationCenter,JU.P3.new3(this.cameraDistanceFromCenter,this.aperatureAngle,this.scalePixelsPerAngstrom)])});c(c$,"setPerspectiveDepth",function(a){this.perspectiveDepth!=a&&(this.perspectiveDepth=a,this.vwr.g.setB("perspectiveDepth",a),this.resetFitToScreen(!1))},"~B");c(c$,"getPerspectiveDepth",function(){return this.perspectiveDepth});c(c$,"setCameraDepthPercent",function(a,b){this.resetNavigationPoint(b);
var c=0>a?-a/100:a;0!=c&&(this.cameraDepthSetting=c,this.vwr.g.setF("cameraDepth",this.cameraDepthSetting),this.cameraDepth=NaN)},"~N,~B");c(c$,"getCameraDepth",function(){return this.cameraDepthSetting});c(c$,"setScreenParameters0",function(a,b,c,g,f,e){2147483647!=a&&(this.screenWidth=a,this.screenHeight=b,this.useZoomLarge=c,this.width=(this.antialias=g)?2*a:a,this.height=g?2*b:b,this.scaleFitToScreen(!1,c,f,e))},"~N,~N,~B,~B,~B,~B");c(c$,"setAntialias",function(a){var b=this.antialias!=a;this.width=
(this.antialias=a)?2*this.screenWidth:this.screenWidth;this.height=this.antialias?2*this.screenHeight:this.screenHeight;b&&this.scaleFitToScreen(!1,this.useZoomLarge,!1,!1)},"~B");c(c$,"defaultScaleToScreen",function(a){return this.screenPixelCount/2/a},"~N");c(c$,"resetFitToScreen",function(a){this.scaleFitToScreen(a,this.vwr.g.zoomLarge,!0,!0)},"~B");c(c$,"scaleFitToScreen",function(a,b,c,g){0==this.width||0==this.height?this.screenPixelCount=1:(this.fixedTranslation.set(this.width*(a?0.5:this.xTranslationFraction),
this.height*(a?0.5:this.yTranslationFraction),0),this.setTranslationFractions(),a&&this.camera.set(0,0,0),g&&this.resetNavigationPoint(c),this.zoomHeight&&(b=this.height>this.width),this.screenPixelCount=b==this.height>this.width?this.height:this.width);2<this.screenPixelCount&&(this.screenPixelCount-=2);this.scaleDefaultPixelsPerAngstrom=this.defaultScaleToScreen(this.modelRadius)},"~B,~B,~B,~B");c(c$,"scaleToScreen",function(a,b){if(0==b||2>a)return 0;var c=this.scaleToPerspective(a,b*this.scalePixelsPerAngstrom/
1E3);return 0<c?c:1},"~N,~N");c(c$,"unscaleToScreen",function(a,b){var c=b/this.scalePixelsPerAngstrom;return this.perspectiveDepth?c/this.getPerspectiveFactor(a):c},"~N,~N");c(c$,"scaleToPerspective",function(a,b){return this.perspectiveDepth?b*this.getPerspectiveFactor(a):b},"~N,~N");c(c$,"setNavigationMode",function(a){this.mode=a?1:this.defaultMode;this.resetNavigationPoint(!0)},"~B");c(c$,"isNavigating",function(){return this.navigating||this.navOn});c(c$,"finalizeTransformParameters",function(){this.haveNotifiedNaN=
!1;this.fixedRotationOffset.setT(this.fixedTranslation);this.camera.setT(this.cameraSetting);this.internalSlab=this.slabEnabled&&(null!=this.slabPlane||null!=this.depthPlane);var a=this.getZoomSetting();this.zmPct!=a&&(this.zmPct=a,this.vwr.g.fontCaching||this.vwr.gdata.clearFontCache());this.calcCameraFactors();this.calcTransformMatrix();1==this.mode?this.calcNavigationPoint():this.calcSlabAndDepthValues()});c(c$,"getZoomSetting",function(){5>this.zmPctSet&&(this.zmPctSet=5);2E5<this.zmPctSet&&(this.zmPctSet=
2E5);return this.zoomEnabled||1==this.mode?this.zmPctSet:100});c(c$,"calcSlabAndDepthValues",function(){this.slabValue=1>this.slabRange?this.zValueFromPercent(this.slabPercentSetting):w(Math.floor(this.modelCenterOffset*this.slabRange/(2*this.modelRadius)*(this.zmPctSet/100)));this.depthValue=this.zValueFromPercent(this.depthPercentSetting);this.zSlabPercentSetting==this.zDepthPercentSetting?(this.zSlabValue=this.slabValue,this.zDepthValue=this.depthValue):(this.zSlabValue=this.zValueFromPercent(this.zSlabPercentSetting),
this.zDepthValue=this.zValueFromPercent(this.zDepthPercentSetting));if(null!=this.zSlabPoint)try{this.transformPt3f(this.zSlabPoint,this.pointT2),this.zSlabValue=A(this.pointT2.z)}catch(a){if(!H(a,Exception))throw a;}this.vwr.g.setO("_slabPlane",JU.Escape.eP4(this.getSlabDepthPlane(!1)));this.vwr.g.setO("_depthPlane",JU.Escape.eP4(this.getSlabDepthPlane(!0)));this.slabEnabled||(this.slabValue=0,this.depthValue=2147483647)});c(c$,"zValueFromPercent",function(a){return w(Math.floor((1-a/50)*this.modelRadiusPixels+
this.modelCenterOffset))},"~N");c(c$,"calcTransformMatrix",function(){this.matrixTransform.setIdentity();this.vectorTemp.sub2(this.frameOffset,this.fixedRotationCenter);this.matrixTransform.setTranslation(this.vectorTemp);this.matrixTemp.setToM3(this.stereoFrame?this.matrixStereo:this.matrixRotate);this.matrixTransform.mul2(this.matrixTemp,this.matrixTransform);this.matrixTemp.setIdentity();this.matrixTemp.m00=this.matrixTemp.m11=this.matrixTemp.m22=this.scalePixelsPerAngstrom;this.matrixTemp.m11=
this.matrixTemp.m22=-this.scalePixelsPerAngstrom;this.matrixTransform.mul2(this.matrixTemp,this.matrixTransform);this.matrixTransform.m23+=this.modelCenterOffset;try{this.matrixTransformInv.setM4(this.matrixTransform).invert()}catch(a){if(H(a,Exception))System.out.println("ERROR INVERTING matrixTransform!");else throw a;}});c(c$,"rotatePoint",function(a,b){this.matrixRotate.rotate2(a,b);b.y=-b.y},"JU.T3,JU.T3");c(c$,"getScreenTemp",function(a){this.matrixTransform.rotTrans2(a,this.fScrPt)},"JU.T3");
c(c$,"transformPtScr",function(a,b){b.setT(this.transformPt(a))},"JU.T3,JU.P3i");c(c$,"transformPtScrT3",function(a,b){this.transformPt(a);b.setT(this.fScrPt)},"JU.T3,JU.T3");c(c$,"transformPt3f",function(a,b){this.applyPerspective(a,a);b.setT(this.fScrPt)},"JU.T3,JU.P3");c(c$,"transformPtNoClip",function(a,b){this.applyPerspective(a,null);b.setT(this.fScrPt)},"JU.T3,JU.T3");c(c$,"transformPt",function(a){return this.applyPerspective(a,this.internalSlab?a:null)},"JU.T3");c(c$,"transformPtVib",function(a,
b){this.ptVibTemp.setT(a);return this.applyPerspective(this.getVibrationPoint(b,this.ptVibTemp,NaN),a)},"JU.P3,JU.Vibration");c(c$,"getVibrationPoint",function(a,b,c){return a.setCalcPoint(b,this.vibrationT,Float.isNaN(c)?this.vibrationScale:c,this.vwr.g.modulationScale)},"JU.Vibration,JU.T3,~N");c(c$,"transformPt2D",function(a){-3.4028235E38==a.z?(this.iScrPt.x=w(Math.floor(a.x/100*this.screenWidth)),this.iScrPt.y=w(Math.floor((1-a.y/100)*this.screenHeight))):(this.iScrPt.x=A(a.x),this.iScrPt.y=
this.screenHeight-A(a.y));this.antialias&&(this.iScrPt.x<<=1,this.iScrPt.y<<=1);this.matrixTransform.rotTrans2(this.fixedRotationCenter,this.fScrPt);this.iScrPt.z=A(this.fScrPt.z);return this.iScrPt},"JU.T3");c(c$,"applyPerspective",function(a,b){this.getScreenTemp(a);var c=this.fScrPt.z;Float.isNaN(c)?(!this.haveNotifiedNaN&&JU.Logger.debugging&&JU.Logger.debug("NaN seen in TransformPoint"),this.haveNotifiedNaN=!0,c=this.fScrPt.z=1):0>=c&&(c=this.fScrPt.z=1);switch(this.mode){case 1:this.fScrPt.x-=
this.navigationShiftXY.x;this.fScrPt.y-=this.navigationShiftXY.y;break;case 2:this.fScrPt.x+=this.perspectiveShiftXY.x,this.fScrPt.y+=this.perspectiveShiftXY.y}this.perspectiveDepth&&(c=this.getPerspectiveFactor(c),this.fScrPt.x*=c,this.fScrPt.y*=c);switch(this.mode){case 1:this.fScrPt.x+=this.navigationOffset.x;this.fScrPt.y+=this.navigationOffset.y;break;case 2:this.fScrPt.x-=this.perspectiveShiftXY.x,this.fScrPt.y-=this.perspectiveShiftXY.y;case 0:this.fScrPt.x+=this.fixedRotationOffset.x,this.fScrPt.y+=
this.fixedRotationOffset.y}Float.isNaN(this.fScrPt.x)&&!this.haveNotifiedNaN&&(JU.Logger.debugging&&JU.Logger.debug("NaN found in transformPoint "),this.haveNotifiedNaN=!0);this.iScrPt.set(A(this.fScrPt.x),A(this.fScrPt.y),A(this.fScrPt.z));null!=b&&this.xyzIsSlabbedInternal(b)&&(this.fScrPt.z=this.iScrPt.z=1);return this.iScrPt},"JU.T3,JU.T3");c(c$,"xyzIsSlabbedInternal",function(a){return null!=this.slabPlane&&0<a.x*this.slabPlane.x+a.y*this.slabPlane.y+a.z*this.slabPlane.z+this.slabPlane.w||null!=
this.depthPlane&&0>a.x*this.depthPlane.x+a.y*this.depthPlane.y+a.z*this.depthPlane.z+this.depthPlane.w},"JU.T3");c(c$,"move",function(a,b,c,g,f,e,h){this.movetoThread=J.api.Interface.getOption("thread.MoveToThread",this.vwr,"tm");this.movetoThread.setManager(this,this.vwr,u(-1,[b,g,K(-1,[c,f,e,h])]));0<e&&this.movetoThread.setEval(a);this.movetoThread.run()},"J.api.JmolScriptEvaluator,JU.V3,~N,JU.V3,~N,~N,~N");c(c$,"isInPosition",function(a,b){if(Float.isNaN(b))return!0;this.aaTest1.setVA(a,b/57.29577951308232);
this.ptTest1.set(4.321,1.23456,3.14159);this.getRotation(this.matrixTest);this.matrixTest.rotate2(this.ptTest1,this.ptTest2);this.matrixTest.setAA(this.aaTest1).rotate2(this.ptTest1,this.ptTest3);return 0.1>this.ptTest3.distance(this.ptTest2)},"JU.V3,~N");c(c$,"moveToPyMOL",function(a,b,c){var g=JU.M3.newA9(c);g.invert();var f=c[9],e=-c[10],h=-c[11],j=JU.P3.new3(c[12],c[13],c[14]),l=c[15],n=c[16],m=c[17];this.setPerspectiveDepth(!(0<=m));var m=Math.abs(m)/2,p=Math.tan(3.141592653589793*m/180),m=h*
p,p=0.5/p-0.5,q=50/m;0<l&&(l=50+A((h-l)*q),h=50+A((h-n)*q),this.setSlabEnabled(!0),this.slabToPercent(l),this.depthToPercent(h),21==c.length&&(n=0!=c[18],q=0!=c[19],c=c[20],this.setZShadeEnabled(n),n&&(q?this.vwr.setIntProperty("zSlab",A(Math.min(100,l+c*(h-l)))):this.vwr.setIntProperty("zSlab",A((l+h)/2)),this.vwr.setIntProperty("zDepth",h))));this.moveTo(a,b,j,null,0,g,100,NaN,NaN,m,null,NaN,NaN,NaN,p,f,e);return!0},"J.api.JmolScriptEvaluator,~N,~A");c(c$,"moveTo",function(a,b,c,g,f,e,h,j,l,n,m,
p,q,s,t,v,w){if(null==e)if(e=new JU.M3,g=JU.V3.newV(g),Float.isNaN(f))e.m00=NaN;else if(0.01>f&&-0.01<f)e.setScale(1);else{if(0==g.x&&0==g.y&&0==g.z)return;var A=new JU.A4;A.setVA(g,f/57.29577951308232);e.setAA(A)}v==this.cameraSetting.x&&(v=NaN);w==this.cameraSetting.y&&(w=NaN);t==this.cameraDepth&&(t=NaN);Float.isNaN(v)||(j=50*v/n/this.width*this.screenPixelCount);Float.isNaN(w)||(l=50*w/n/this.height*this.screenPixelCount);f=null==c?this.scaleDefaultPixelsPerAngstrom:this.defaultScaleToScreen(n);
if(0>=b)this.setAll(c,e,m,h,j,l,n,f,s,p,q,t,v,w),this.vwr.moveUpdate(b),this.vwr.finalizeTransformParameters();else try{null==this.movetoThread&&(this.movetoThread=J.api.Interface.getOption("thread.MoveToThread",this.vwr,"tm"));var B=this.movetoThread.setManager(this,this.vwr,u(-1,[c,e,m,K(-1,[b,h,j,l,n,f,s,p,q,t,v,w])]));0>=B||this.vwr.g.waitForMoveTo?(0<B&&this.movetoThread.setEval(a),this.movetoThread.run(),this.vwr.isSingleThreaded||(this.movetoThread=null)):this.movetoThread.start()}catch(D){if(!H(D,
Exception))throw D;}},"J.api.JmolScriptEvaluator,~N,JU.P3,JU.T3,~N,JU.M3,~N,~N,~N,~N,JU.P3,~N,~N,~N,~N,~N,~N");c(c$,"setAll",function(a,b,c,g,f,e,h,j,l,n,m,p,q,s){Float.isNaN(b.m00)||this.setRotation(b);null!=a&&this.moveRotationCenter(a,!this.windowCentered);null!=c&&1==this.mode&&this.navigationCenter.setT(c);Float.isNaN(p)||this.setCameraDepthPercent(p,!1);!Float.isNaN(q)&&!Float.isNaN(s)&&this.setCamera(q,s);Float.isNaN(g)||this.zoomToPercent(g);Float.isNaN(h)||(this.modelRadius=h);Float.isNaN(j)||
(this.scaleDefaultPixelsPerAngstrom=j);!Float.isNaN(f)&&!Float.isNaN(e)&&(this.translateToPercent("x",f),this.translateToPercent("y",e));1==this.mode&&(!Float.isNaN(n)&&!Float.isNaN(m)&&this.navTranslatePercentOrTo(0,n,m),Float.isNaN(l)||this.setNavigationDepthPercent(l))},"JU.P3,JU.M3,JU.P3,~N,~N,~N,~N,~N,~N,~N,~N,~N,~N,~N");c(c$,"stopMotion",function(){this.movetoThread=null});c(c$,"getRotationText",function(){this.axisangleT.setM(this.matrixRotate);var a=57.29577951308232*this.axisangleT.angle,
b=new JU.SB;this.vectorT.set(this.axisangleT.x,this.axisangleT.y,this.axisangleT.z);if(0.01>a)return"{0 0 1 0}";this.vectorT.normalize();this.vectorT.scale(1E3);b.append("{");JV.TransformManager.truncate0(b,this.vectorT.x);JV.TransformManager.truncate0(b,this.vectorT.y);JV.TransformManager.truncate0(b,this.vectorT.z);JV.TransformManager.truncate2(b,a);b.append("}");return b.toString()});c(c$,"getMoveToText",function(a,b){this.finalizeTransformParameters();var c=new JU.SB;c.append("moveto ");b&&c.append("/* time, axisAngle */ ");
c.appendF(a);c.append(" ").append(this.getRotationText());b&&c.append(" /* zoom, translation */ ");JV.TransformManager.truncate2(c,this.zmPctSet);JV.TransformManager.truncate2(c,this.getTranslationXPercent());JV.TransformManager.truncate2(c,this.getTranslationYPercent());c.append(" ");b&&c.append(" /* center, rotationRadius */ ");c.append(this.getCenterText());c.append(" ").appendF(this.modelRadius);c.append(this.getNavigationText(b));b&&c.append(" /* cameraDepth, cameraX, cameraY */ ");JV.TransformManager.truncate2(c,
this.cameraDepth);JV.TransformManager.truncate2(c,this.cameraSetting.x);JV.TransformManager.truncate2(c,this.cameraSetting.y);c.append(";");return c.toString()},"~N,~B");c(c$,"getCenterText",function(){return JU.Escape.eP(this.fixedRotationCenter)});c(c$,"getRotateXyzText",function(){var a=new JU.SB,b=this.matrixRotate.m20,c=-(57.29577951308232*Math.asin(b)),g;0.999<b||-0.999>b?(b=-(57.29577951308232*Math.atan2(this.matrixRotate.m12,this.matrixRotate.m11)),g=0):(b=57.29577951308232*Math.atan2(this.matrixRotate.m21,
this.matrixRotate.m22),g=57.29577951308232*Math.atan2(this.matrixRotate.m10,this.matrixRotate.m00));a.append("reset");a.append(";center ").append(this.getCenterText());0!=b&&(a.append("; rotate x"),JV.TransformManager.truncate2(a,b));0!=c&&(a.append("; rotate y"),JV.TransformManager.truncate2(a,c));0!=g&&(a.append("; rotate z"),JV.TransformManager.truncate2(a,g));a.append(";");this.addZoomTranslationNavigationText(a);return a.toString()});c(c$,"addZoomTranslationNavigationText",function(a){100!=this.zmPct&&
(a.append(" zoom"),JV.TransformManager.truncate2(a,this.zmPct),a.append(";"));var b=this.getTranslationXPercent();0!=b&&(a.append(" translate x"),JV.TransformManager.truncate2(a,b),a.append(";"));b=this.getTranslationYPercent();0!=b&&(a.append(" translate y"),JV.TransformManager.truncate2(a,b),a.append(";"));if(this.modelRadius!=this.rotationRadiusDefault||10==this.modelRadius)a.append(" set rotationRadius"),JV.TransformManager.truncate2(a,this.modelRadius),a.append(";");1==this.mode&&(a.append("navigate 0 center ").append(JU.Escape.eP(this.navigationCenter)),
a.append(";navigate 0 translate"),JV.TransformManager.truncate2(a,this.getNavigationOffsetPercent("X")),JV.TransformManager.truncate2(a,this.getNavigationOffsetPercent("Y")),a.append(";navigate 0 depth "),JV.TransformManager.truncate2(a,this.navigationDepthPercent),a.append(";"))},"JU.SB");c(c$,"getRotateZyzText",function(a){var b=new JU.SB,c=this.vwr.ms.getInfoM("defaultOrientationMatrix");null==c?c=this.matrixRotate:(c=JU.M3.newM3(c),c.invert(),c.mul2(this.matrixRotate,c));var g=c.m22,f=57.29577951308232*
Math.acos(g);0.999<g||-0.999>g?(g=57.29577951308232*Math.atan2(c.m10,c.m11),c=0):(g=57.29577951308232*Math.atan2(c.m21,-c.m20),c=57.29577951308232*Math.atan2(c.m12,c.m02));0!=g&&(0!=f&&0!=c&&a)&&b.append("#Follows Z-Y-Z convention for Euler angles\n");b.append("reset");b.append(";center ").append(this.getCenterText());0!=g&&(b.append("; rotate z"),JV.TransformManager.truncate2(b,g));0!=f&&(b.append("; rotate y"),JV.TransformManager.truncate2(b,f));0!=c&&(b.append("; rotate z"),JV.TransformManager.truncate2(b,
c));b.append(";");this.addZoomTranslationNavigationText(b);return b.toString()},"~B");c$.truncate0=c(c$,"truncate0",function(a,b){a.appendC(" ");a.appendI(Math.round(b))},"JU.SB,~N");c$.truncate2=c(c$,"truncate2",function(a,b){a.appendC(" ");a.appendF(Math.round(100*b)/100)},"JU.SB,~N");c(c$,"setSpinXYZ",function(a,b,c){Float.isNaN(a)||(this.spinX=a);Float.isNaN(b)||(this.spinY=b);Float.isNaN(c)||(this.spinZ=c);(this.isSpinInternal||this.isSpinFixed)&&this.clearSpin()},"~N,~N,~N");c(c$,"setSpinFps",
function(a){0>=a?a=1:50<a&&(a=50);this.spinFps=a},"~N");c(c$,"setNavXYZ",function(a,b,c){Float.isNaN(a)||(this.navX=a);Float.isNaN(b)||(this.navY=b);Float.isNaN(c)||(this.navZ=c)},"~N,~N,~N");c(c$,"clearSpin",function(){this.setSpinOff();this.setNavOn(!1);this.isSpinFixed=this.isSpinInternal=!1});c(c$,"setSpinOn",function(){this.setSpin(null,!0,3.4028235E38,null,null,null,!1)});c(c$,"setSpinOff",function(){this.setSpin(null,!1,3.4028235E38,null,null,null,!1)});c(c$,"setSpin",function(a,b,c,g,f,e,
h){this.navOn&&b&&this.setNavOn(!1);this.spinOn!=b&&(this.spinOn=b,this.vwr.g.setB("_spinning",b),b?null==this.spinThread&&(this.spinThread=J.api.Interface.getOption("thread.SpinThread",this.vwr,"tm"),this.spinThread.setManager(this,this.vwr,u(-1,[Float.$valueOf(c),g,f,e,h?Boolean.TRUE:null])),this.spinIsGesture=h,Float.isNaN(c)||3.4028235E38==c||!this.vwr.g.waitForMoveTo?this.spinThread.start():(this.spinThread.setEval(a),this.spinThread.run())):null!=this.spinThread&&(this.spinThread.reset(),this.spinThread=
null))},"J.api.JmolScriptEvaluator,~B,~N,JU.Lst,~A,JU.BS,~B");c(c$,"setNavOn",function(a){if(!Float.isNaN(this.navFps)){var b=this.navOn;a&&this.spinOn&&this.setSpin(null,!1,0,null,null,null,!1);this.navOn=a;this.vwr.g.setB("_navigating",a);a||this.navInterrupt();a?(0==this.navX&&(0==this.navY&&0==this.navZ)&&(this.navZ=1),0==this.navFps&&(this.navFps=10),null==this.spinThread&&(this.spinThread=J.api.Interface.getOption("thread.SpinThread",this.vwr,"tm"),this.spinThread.setManager(this,this.vwr,null),
this.spinThread.start())):b&&null!=this.spinThread&&(this.spinThread.interrupt(),this.spinThread=null)}},"~B");c(c$,"setVibrationScale",function(a){this.vibrationScale=a},"~N");c(c$,"setVibrationPeriod",function(a){if(Float.isNaN(a))a=this.vibrationPeriod;else if(0==a)this.vibrationPeriodMs=this.vibrationPeriod=0;else{this.vibrationPeriod=Math.abs(a);this.vibrationPeriodMs=A(1E3*this.vibrationPeriod);if(0<a)return;a=-a}this.setVibrationOn(0<a&&0<=this.vwr.ms.getLastVibrationVector(this.vwr.am.cmi,
0))},"~N");c(c$,"setVibrationT",function(a){this.vibrationT.x=a;0==this.vibrationScale&&(this.vibrationScale=this.vwr.g.vibrationScale)},"~N");c(c$,"isVibrationOn",function(){return this.vibrationOn});c(c$,"setVibrationOn",function(a){a?1>this.vwr.ms.mc?(this.vibrationOn=!1,this.vibrationT.x=0):(null==this.vibrationThread&&(this.vibrationThread=J.api.Interface.getOption("thread.VibrationThread",this.vwr,"tm"),this.vibrationThread.setManager(this,this.vwr,null),this.vibrationThread.start()),this.vibrationOn=
!0):(null!=this.vibrationThread&&(this.vibrationThread.interrupt(),this.vibrationThread=null),this.vibrationOn=!1,this.vibrationT.x=0)},"~B");c(c$,"clearVibration",function(){this.setVibrationOn(!1);this.vibrationScale=0});c(c$,"setStereoMode2",function(a){this.stereoMode=J.c.STER.CUSTOM;this.stereoColors=a},"~A");c(c$,"setStereoMode",function(a){this.stereoColors=null;this.stereoMode=a;this.stereoDoubleDTI=a===J.c.STER.DTI;this.stereoDoubleFull=a===J.c.STER.DOUBLE},"J.c.STER");c(c$,"setStereoDegrees",
function(a){this.stereoDegrees=a;this.stereoRadians=0.017453292*a},"~N");c(c$,"getStereoRotationMatrix",function(a){this.stereoFrame=a;if(!a)return this.matrixRotate;this.matrixTemp3.setAsYRotation(-this.stereoRadians);this.matrixStereo.mul2(this.matrixTemp3,this.matrixRotate);return this.matrixStereo},"~B");c(c$,"isWindowCentered",function(){return this.windowCentered});c(c$,"setWindowCentered",function(a){this.windowCentered=a;this.resetNavigationPoint(!0)},"~B");c(c$,"setRotationRadius",function(a,
b){a=this.modelRadius=0>=a?this.vwr.ms.calcRotationRadius(this.vwr.am.cmi,this.fixedRotationCenter,!0):a;b&&this.vwr.setRotationRadius(a,!1);return a},"~N,~B");c(c$,"setRotationCenterAndRadiusXYZ",function(a,b){this.resetNavigationPoint(!1);null==a?(this.setFixedRotationCenter(this.rotationCenterDefault),this.modelRadius=this.rotationRadiusDefault):(this.setFixedRotationCenter(a),b&&this.windowCentered&&(this.modelRadius=this.vwr.ms.calcRotationRadius(this.vwr.am.cmi,this.fixedRotationCenter,!0)))},
"JU.T3,~B");c(c$,"setNewRotationCenter",function(a,b){null==a&&(a=this.rotationCenterDefault);this.windowCentered?(this.translateToPercent("x",0),this.translateToPercent("y",0),this.setRotationCenterAndRadiusXYZ(a,!0),b&&this.resetFitToScreen(!0)):this.moveRotationCenter(a,!0)},"JU.P3,~B");c(c$,"moveRotationCenter",function(a,b){this.setRotationCenterAndRadiusXYZ(a,!1);b&&this.setRotationPointXY(this.fixedRotationCenter)},"JU.P3,~B");c(c$,"setCenter",function(){this.setRotationCenterAndRadiusXYZ(this.fixedRotationCenter,
!0)});c(c$,"setCenterAt",function(a,b){var c=JU.P3.newP(b);switch(a){case 1073741826:break;case 96:c.add(this.vwr.ms.getAverageAtomPoint());break;case 1678381065:c.add(this.vwr.getBoundBoxCenter());break;default:c.setT(this.rotationCenterDefault)}this.setRotationCenterAndRadiusXYZ(c,!0);this.resetFitToScreen(!0)},"~N,JU.P3");c(c$,"setFrameOffset",function(a){null==this.frameOffsets||0>a||a>=this.frameOffsets.length?this.frameOffset.set(0,0,0):this.frameOffset.setT(this.frameOffsets[a])},"~N");c(c$,
"setSelectedTranslation",function(a,b,c){this.bsSelectedAtoms=a;switch(b){case "X":case "x":this.ptOffset.x+=c;break;case "Y":case "y":this.ptOffset.y+=c;break;case "Z":case "z":this.ptOffset.z+=c}},"JU.BS,~S,~N");c(c$,"setNavFps",function(a){this.navFps=a},"~N");c(c$,"calcCameraFactors",function(){Float.isNaN(this.cameraDepth)&&(this.cameraDepth=this.cameraDepthSetting,this.zoomFactor=3.4028235E38);this.cameraDistance=this.cameraDepth*this.screenPixelCount;this.referencePlaneOffset=this.cameraDistance+
this.screenPixelCount/2;this.scalePixelsPerAngstrom=this.scale3D&&!this.perspectiveDepth&&1!=this.mode?72/this.scale3DAngstromsPerInch*(this.antialias?2:1):this.screenPixelCount/this.visualRangeAngstroms;1!=this.mode&&(this.mode=0==this.camera.z?0:2);this.perspectiveShiftXY.set(0==this.camera.z?0:100*(this.camera.x*this.scalePixelsPerAngstrom/this.screenWidth),0==this.camera.z?0:100*(this.camera.y*this.scalePixelsPerAngstrom/this.screenHeight),0);this.modelRadiusPixels=this.modelRadius*this.scalePixelsPerAngstrom;
var a=2*this.modelRadius/this.visualRangeAngstroms*this.referencePlaneOffset;if(1==this.mode)this.calcNavCameraFactors(a);else{this.zoomFactor=3.4028235E38;this.modelCenterOffset=this.referencePlaneOffset;if(!this.scale3D||this.perspectiveDepth)this.scalePixelsPerAngstrom*=this.modelCenterOffset/a*this.zmPct/100;this.modelRadiusPixels=this.modelRadius*this.scalePixelsPerAngstrom}});c(c$,"calcNavCameraFactors",function(a){3.4028235E38==this.zoomFactor?(1E4<this.zmPct&&(this.zmPct=1E4),this.modelCenterOffset=
100*a/this.zmPct):this.prevZoomSetting!=this.zmPctSet&&(this.modelCenterOffset=0==this.zoomRatio?100*a/this.zmPctSet:this.modelCenterOffset+(1-this.zoomRatio)*this.referencePlaneOffset,this.navMode=-1);this.prevZoomSetting=this.zmPctSet;this.zoomFactor=this.modelCenterOffset/this.referencePlaneOffset;this.zmPct=0==this.zoomFactor?1E4:100*(a/this.modelCenterOffset)},"~N");c(c$,"getPerspectiveFactor",function(a){return 0>=a?this.referencePlaneOffset:this.referencePlaneOffset/a},"~N");c(c$,"unTransformPoint",
function(a,b){this.untransformedPoint.setT(a);switch(this.mode){case 1:this.untransformedPoint.x-=this.navigationOffset.x;this.untransformedPoint.y-=this.navigationOffset.y;break;case 2:this.fScrPt.x+=this.perspectiveShiftXY.x,this.fScrPt.y+=this.perspectiveShiftXY.y;case 0:this.untransformedPoint.x-=this.fixedRotationOffset.x,this.untransformedPoint.y-=this.fixedRotationOffset.y}if(this.perspectiveDepth){var c=this.getPerspectiveFactor(this.untransformedPoint.z);this.untransformedPoint.x/=c;this.untransformedPoint.y/=
c}switch(this.mode){case 1:this.untransformedPoint.x+=this.navigationShiftXY.x;this.untransformedPoint.y+=this.navigationShiftXY.y;break;case 2:this.untransformedPoint.x-=this.perspectiveShiftXY.x,this.untransformedPoint.y-=this.perspectiveShiftXY.y}this.matrixTransformInv.rotTrans2(this.untransformedPoint,b)},"JU.T3,JU.T3");c(c$,"resetNavigationPoint",function(a){5>this.zmPct&&1!=this.mode?(this.perspectiveDepth=!0,this.mode=1):(1==this.mode?(this.navMode=1,this.slabPercentSetting=0,this.perspectiveDepth=
!0):a&&(this.slabPercentSetting=100),this.vwr.setFloatProperty("slabRange",0),a&&this.setSlabEnabled(1==this.mode),this.zoomFactor=3.4028235E38,this.zmPctSet=this.zmPct)},"~B");c(c$,"setNavigatePt",function(a){this.navigationCenter.setT(a);this.navMode=3;this.navigating=!0;this.finalizeTransformParameters();this.navigating=!1},"JU.P3");c(c$,"setNavigationSlabOffsetPercent",function(a){this.vwr.g.setF("navigationSlab",a);this.calcCameraFactors();this.navigationSlabOffset=a/50*this.modelRadiusPixels},
"~N");c(c$,"getNavigationOffset",function(){this.transformPt3f(this.navigationCenter,this.navigationOffset);return this.navigationOffset});c(c$,"getNavPtHeight",function(){return this.height/2});c(c$,"getNavigationOffsetPercent",function(a){this.getNavigationOffset();return 0==this.width||0==this.height?0:"X"==a?100*(this.navigationOffset.x-this.width/2)/this.width:100*(this.navigationOffset.y-this.getNavPtHeight())/this.height},"~S");c(c$,"getNavigationText",function(a){a=a?" /* navigation center, translation, depth */ ":
" ";if(1!=this.mode)return a+"{0 0 0} 0 0 0";this.getNavigationOffset();return a+JU.Escape.eP(this.navigationCenter)+" "+this.getNavigationOffsetPercent("X")+" "+this.getNavigationOffsetPercent("Y")+" "+this.navigationDepthPercent},"~B");c(c$,"setScreenParameters",function(a,b,c,g,f,e){var h=1==this.mode?JU.P3.newP(this.navigationCenter):null,j=JU.P3.newP(this.navigationOffset);j.x/=this.width;j.y/=this.height;this.setScreenParameters0(a,b,c,g,f,e);null!=h&&(this.navigationCenter.setT(h),this.navTranslatePercentOrTo(-1,
j.x*this.width,j.y*this.height),this.setNavigatePt(h))},"~N,~N,~B,~B,~B,~B");c(c$,"navInterrupt",function(){null!=this.nav&&this.nav.interrupt()});c(c$,"getNav",function(){if(null!=this.nav)return!0;this.nav=J.api.Interface.getOption("navigate.Navigator",this.vwr,"tm");if(null==this.nav)return!1;this.nav.set(this,this.vwr);return!0});c(c$,"navigateList",function(a,b){this.getNav()&&this.nav.navigateList(a,b)},"J.api.JmolScriptEvaluator,JU.Lst");c(c$,"navigateAxis",function(a,b){this.getNav()&&this.nav.navigateAxis(a,
b)},"JU.V3,~N");c(c$,"setNavigationOffsetRelative",function(){this.getNav()&&this.nav.setNavigationOffsetRelative()});c(c$,"navigateKey",function(a,b){this.getNav()&&this.nav.navigateKey(a,b)},"~N,~N");c(c$,"setNavigationDepthPercent",function(a){this.getNav()&&this.nav.setNavigationDepthPercent(a)},"~N");c(c$,"navTranslatePercentOrTo",function(a,b,c){this.getNav()&&this.nav.navTranslatePercentOrTo(a,b,c)},"~N,~N,~N");c(c$,"calcNavigationPoint",function(){this.getNav()&&this.nav.calcNavigationPoint()});
c(c$,"getNavigationState",function(){return 1==this.mode&&this.getNav()?this.nav.getNavigationState():""});E(c$,"DEFAULT_SPIN_Y",30,"DEFAULT_SPIN_FPS",30,"DEFAULT_NAV_FPS",10,"DEFAULT_VISUAL_RANGE",5,"DEFAULT_STEREO_DEGREES",-5,"MODE_STANDARD",0,"MODE_NAVIGATION",1,"MODE_PERSPECTIVE_PYMOL",2,"DEFAULT_PERSPECTIVE_MODEL",11,"DEFAULT_PERSPECTIVE_DEPTH",!0,"DEFAULT_CAMERA_DEPTH",3,"degreesPerRadian",57.29577951308232,"MAXIMUM_ZOOM_PERCENTAGE",2E5,"MAXIMUM_ZOOM_PERSPECTIVE_DEPTH",1E4,"NAV_MODE_IGNORE",
-2,"NAV_MODE_ZOOMED",-1,"NAV_MODE_NONE",0,"NAV_MODE_RESET",1,"NAV_MODE_NEWXY",2,"NAV_MODE_NEWXYZ",3,"NAV_MODE_NEWZ",4)});s("JV");v(["java.lang.Enum","J.api.JmolViewer","$.PlatformViewer","J.atomdata.AtomDataServer","java.util.Hashtable"],"JV.Viewer","java.io.BufferedInputStream $.BufferedReader $.Reader java.lang.Boolean $.Character $.Float $.NullPointerException java.util.Arrays JU.AU $.BS $.CU $.DF $.Lst $.P3 $.P3i $.PT $.Quat $.Rdr $.SB J.adapter.smarter.SmarterJmolAdapter J.api.Interface $.JmolAppConsoleInterface J.atomdata.RadiusData J.c.FIL $.STER $.VDW J.i18n.GT JM.ModelSet JS.SV $.T J.thread.TimeoutThread JU.BSUtil $.C $.CommandHistory $.Elements $.Escape $.GData $.JmolMolecule $.Logger $.Parser $.TempArray JV.ActionManager $.AnimationManager $.ColorManager $.FileManager $.GlobalSettings $.JC $.ModelManager $.SelectionManager $.ShapeManager $.StateManager $.StatusManager $.TransformManager JV.binding.Binding".split(" "),
function(){c$=t(function(){this.queueOnHold=this.isSingleThreaded=this.isWebGL=this.isJSNoAWT=this.haveDisplay=this.autoExit=this.testAsync=!1;this.fullName="";this.fm=this.ms=this.definedAtomSets=this.compiler=null;this.mustRender=this.listCommands=this.isSyntaxCheck=this.isSyntaxAndFileCheck=this.isJNLP=this.isApplet=!1;this.appletName=this.htmlName="";this.tryPt=0;this.insertedCommand="";this.tm=this.sm=this.g=this.rm=this.slm=this.shm=this.dm=this.cm=this.am=this.acm=this.html5Applet=this.gdata=
null;this.logFilePath=this.syncId="";this.useCommandThread=this.noGraphicsAllowed=this.multiTouch=this.isSilent=this.isSignedAppletLocal=this.isSignedApplet=this.isPrintOnly=this.allowScripting=!1;this.tempArray=this.eval=this.scm=this.stm=this.mm=this.commandHistory=this.access=this.modelAdapter=this.display=this.vwrOptions=this.commandOptions=null;this.async=this.allowArrayDotNotation=!1;this.executor=null;this.screenHeight=this.screenWidth=0;this.errorMessageUntranslated=this.errorMessage=this.chainList=
this.chainMap=this.rd=this.defaultVdw=this.actionStatesRedo=this.actionStates=null;this.privateKey=0;this.dataOnly=!1;this.maximumSize=2147483647;this.gRight=null;this.isStereoSlave=!1;this.imageFontScaling=1;this.antialiased=!1;this.prevFrame=-2147483648;this.prevMorphModel=0;this.haveJDX=!1;this.jzt=this.outputManager=this.jsv=null;this.headless=this.isPreviewOnly=!1;this.lastData=this.jsc=this.smilesMatcher=this.minimizer=this.dssrParser=this.annotationParser=this.ligandModelSet=this.ligandModels=
this.mouse=this.movableBitSet=null;this.motionEventNumber=0;this.inMotion=!1;this.refreshing=!0;this.axesAreTainted=!1;this.jsParams=this.captureParams=null;this.cirChecked=!1;this.hoverAtomIndex=-1;this.hoverText=null;this.hoverLabel="%U";this.hoverEnabled=!0;this.currentCursor=0;this.ptTemp=null;this.selectionHalosEnabled=!1;this.noFrankEcho=this.frankOn=!0;this.scriptEditorVisible=!1;this.pm=this.headlessImageParams=this.modelkit=this.jmolpopup=this.scriptEditor=this.appConsole=null;this.isTainted=
!0;this.showSelected=this.movingSelected=!1;this.atomHighlighted=-1;this.creatingImage=!1;this.userVdwMars=this.userVdws=this.bsUserVdws=null;this.currentShapeID=-1;this.localFunctions=this.currentShapeState=null;this.$isKiosk=!1;this.displayLoadErrors=!0;this.$isParallel=!1;this.stateScriptVersionInt=2147483647;this.timeouts=this.jsExporter3D=null;this.chainCaseSpecified=!1;this.macros=this.nboParser=this.triangulator=this.jsonParser=this.jcm=this.jbr=this.logFileName=this.nmrCalculation=null;this.consoleFontScale=
1;p(this,arguments)},JV,"Viewer",J.api.JmolViewer,[J.atomdata.AtomDataServer,J.api.PlatformViewer]);c(c$,"finalize",function(){JU.Logger.debugging&&JU.Logger.debug("vwr finalize "+this);V(this,JV.Viewer,"finalize",[])});c(c$,"setInsertedCommand",function(a){this.insertedCommand=a},"~S");c$.getJmolVersion=j(c$,"getJmolVersion",function(){return null==JV.Viewer.version_date?JV.Viewer.version_date=JV.JC.version+"  "+JV.JC.date:JV.Viewer.version_date});c$.allocateViewer=c(c$,"allocateViewer",function(a,
b,c,g,f,e,h,j){var l=new java.util.Hashtable;l.put("display",a);l.put("adapter",b);l.put("statusListener",h);l.put("platform",j);l.put("options",e);l.put("fullName",c);l.put("documentBase",g);l.put("codeBase",f);return new JV.Viewer(l)},"~O,J.api.JmolAdapter,~S,java.net.URL,java.net.URL,~S,J.api.JmolStatusListener,J.api.GenericPlatform");q(c$,function(a){I(this,JV.Viewer,[]);this.commandHistory=new JU.CommandHistory;this.rd=new J.atomdata.RadiusData(null,0,null,null);this.defaultVdw=J.c.VDW.JMOL;
this.localFunctions=new java.util.Hashtable;this.privateKey=Math.random();this.actionStates=new JU.Lst;this.actionStatesRedo=new JU.Lst;this.chainMap=new java.util.Hashtable;this.chainList=new JU.Lst;this.setOptions(a)},"java.util.Map");c(c$,"haveAccess",function(a){return this.access===a},"JV.Viewer.ACCESS");j(c$,"getModelAdapter",function(){return null==this.modelAdapter?this.modelAdapter=new J.adapter.smarter.SmarterJmolAdapter:this.modelAdapter});j(c$,"getSmartsMatch",function(a,b){null==b&&(b=
this.bsA());return this.getSmilesMatcher().getSubstructureSet(a,this.ms.at,this.ms.ac,b,2)},"~S,JU.BS");c(c$,"getSmartsMatchForNodes",function(a,b){return this.getSmilesMatcher().getSubstructureSet(a,b,b.length,null,2)},"~S,~A");c(c$,"getSmartsMap",function(a,b,c){null==b&&(b=this.bsA());0==c&&(c=2);return this.getSmilesMatcher().getCorrelationMaps(a,this.ms.at,this.ms.ac,b,c)},"~S,JU.BS,~N");c(c$,"setOptions",function(a){this.vwrOptions=a;JU.Logger.debugging&&JU.Logger.debug("Viewer constructor "+
this);this.modelAdapter=a.get("adapter");var b=a.get("statusListener");this.fullName=a.get("fullName");null==this.fullName&&(this.fullName="");var c=a.get("codePath");null==c&&(c="../java/");JV.Viewer.appletCodeBase=c.toString();JV.Viewer.appletIdiomaBase=JV.Viewer.appletCodeBase.substring(0,JV.Viewer.appletCodeBase.lastIndexOf("/",JV.Viewer.appletCodeBase.length-2)+1)+"idioma";c=a.get("documentBase");JV.Viewer.appletDocumentBase=null==c?"":c.toString();c=a.get("options");this.commandOptions=null==
c?"":c.toString();(a.containsKey("debug")||0<=this.commandOptions.indexOf("-debug"))&&JU.Logger.setLogLevel(5);this.isApplet&&a.containsKey("maximumSize")&&this.setMaximumSize(a.get("maximumSize").intValue());(this.isJNLP=this.checkOption2("isJNLP","-jnlp"))&&JU.Logger.info("setting JNLP mode TRUE");this.isApplet=(this.isSignedApplet=this.isJNLP||this.checkOption2("signedApplet","-signed"))||this.checkOption2("applet","-applet");this.allowScripting=!this.checkOption2("noscripting","-noscripting");
var g=this.fullName.indexOf("__");this.htmlName=0>g?this.fullName:this.fullName.substring(0,g);this.appletName=JU.PT.split(this.htmlName+"_","_")[0];this.syncId=0>g?"":this.fullName.substring(g+2,this.fullName.length-2);this.access=this.checkOption2("access:READSPT","-r")?JV.Viewer.ACCESS.READSPT:this.checkOption2("access:NONE","-R")?JV.Viewer.ACCESS.NONE:JV.Viewer.ACCESS.ALL;(this.isPreviewOnly=a.containsKey("previewOnly"))&&a.remove("previewOnly");this.isPrintOnly=this.checkOption2("printOnly",
"-p");this.dataOnly=this.checkOption2("isDataOnly","\x00");this.autoExit=this.checkOption2("exit","-x");c=a.get("platform");g="unknown";null==c&&(c=this.commandOptions.contains("platform=")?this.commandOptions.substring(this.commandOptions.indexOf("platform=")+9):"J.awt.Platform");if(n(c,String)){g=c;this.isWebGL=0<=g.indexOf(".awtjs.");JV.Viewer.isJS=this.isJSNoAWT=this.isWebGL||0<=g.indexOf(".awtjs2d.");this.async=!this.dataOnly&&!this.autoExit&&(this.testAsync||JV.Viewer.isJS&&a.containsKey("async"));
var f=c=null,e="?";self.Jmol&&(f=Jmol,c=Jmol._applets[this.htmlName.split("_object")[0]],e=Jmol._version);null!=e&&(this.html5Applet=c,JV.Viewer.jmolObject=f,JV.Viewer.strJavaVersion=e,JV.Viewer.strJavaVendor="Java2Script "+(this.isWebGL?"(WebGL)":"(HTML5)"));c=J.api.Interface.getInterface(g,this,"setOptions")}this.apiPlatform=c;this.display=a.get("display");this.isSingleThreaded=this.apiPlatform.isSingleThreaded();this.noGraphicsAllowed=this.checkOption2("noDisplay","-n");this.headless=this.apiPlatform.isHeadless();
this.haveDisplay=this.isWebGL||null!=this.display&&!this.noGraphicsAllowed&&!this.headless&&!this.dataOnly;this.noGraphicsAllowed=(new Boolean(this.noGraphicsAllowed&null==this.display)).valueOf();this.headless=(new Boolean(this.headless|this.noGraphicsAllowed)).valueOf();this.haveDisplay?(this.mustRender=!0,this.multiTouch=this.checkOption2("multiTouch","-multitouch"),this.isWebGL||(this.display=document.getElementById(this.display))):this.display=null;this.apiPlatform.setViewer(this,this.display);
c=a.get("graphicsAdapter");null==c&&!this.isWebGL&&(c=J.api.Interface.getOption("g3d.Graphics3D",this,"setOptions"));this.gdata=null==c&&(this.isWebGL||!JV.Viewer.isJS)?new JU.GData:c;this.gdata.initialize(this,this.apiPlatform);this.stm=new JV.StateManager(this);this.cm=new JV.ColorManager(this,this.gdata);this.sm=new JV.StatusManager(this);g=a.containsKey("4DMouse");this.tm=JV.TransformManager.getTransformManager(this,2147483647,0,g);this.slm=new JV.SelectionManager(this);this.haveDisplay&&(this.acm=
this.multiTouch?J.api.Interface.getOption("multitouch.ActionManagerMT",null,null):new JV.ActionManager,this.acm.setViewer(this,this.commandOptions+"-multitouch-"+a.get("multiTouch")),this.mouse=this.apiPlatform.getMouseManager(this.privateKey,this.display),this.multiTouch&&!this.checkOption2("-simulated","-simulated")&&this.apiPlatform.setTransparentCursor(this.display));this.mm=new JV.ModelManager(this);this.shm=new JV.ShapeManager(this);this.tempArray=new JU.TempArray;this.am=new JV.AnimationManager(this);
c=a.get("repaintManager");null==c&&(c=J.api.Interface.getOption("render.RepaintManager",this,"setOptions"));if(JV.Viewer.isJS||null!=c&&!c.equals(""))(this.rm=c).set(this,this.shm);this.ms=new JM.ModelSet(this,null);this.initialize(!0,!1);this.fm=new JV.FileManager(this);this.definedAtomSets=new java.util.Hashtable;this.setJmolStatusListener(b);this.isApplet?(JU.Logger.info("vwrOptions: \n"+JU.Escape.escapeMap(this.vwrOptions)),b=this.vwrOptions.get("documentLocation"),!JV.Viewer.isJS&&(null!=b&&
b.startsWith("file:/"))&&(b=b.substring(0,b.substring(0,(b+"?").indexOf("?")).lastIndexOf("/")),JU.Logger.info("setting current directory to "+b),this.cd(b)),b=JV.Viewer.appletDocumentBase,g=b.indexOf("#"),0<=g&&(b=b.substring(0,g)),g=b.lastIndexOf("?"),0<=g&&(b=b.substring(0,g)),g=b.lastIndexOf("/"),0<=g&&(b=b.substring(0,g)),JV.Viewer.jsDocumentBase=b,this.fm.setAppletContext(JV.Viewer.appletDocumentBase),b=a.get("appletProxy"),null!=b&&this.setStringProperty("appletProxy",b),this.isSignedApplet?
(this.logFilePath=JU.PT.rep(JV.Viewer.appletCodeBase,"file://",""),this.logFilePath=JU.PT.rep(this.logFilePath,"file:/",""),0<=this.logFilePath.indexOf("//")?this.logFilePath=null:this.isSignedAppletLocal=!0):JV.Viewer.isJS||(this.logFilePath=null),new J.i18n.GT(this,a.get("language")),JV.Viewer.isJS&&this.acm.createActions()):(this.gdata.setBackgroundTransparent(this.checkOption2("backgroundTransparent","-b")),(this.isSilent=this.checkOption2("silent","-i"))&&JU.Logger.setLogLevel(3),this.headless&&
!this.isSilent&&JU.Logger.info("Operating headless display="+this.display+" nographicsallowed="+this.noGraphicsAllowed),this.isSyntaxCheck=(this.isSyntaxAndFileCheck=this.checkOption2("checkLoad","-C"))||this.checkOption2("check","-c"),this.listCommands=this.checkOption2("listCommands","-l"),this.cd("."),this.headless&&(this.headlessImageParams=a.get("headlessImage"),c=a.get("headlistMaxTimeMs"),null==c&&(c=Integer.$valueOf(6E4)),this.setTimeout(""+Math.random(),c.intValue(),"exitJmol")));this.useCommandThread=
!this.headless&&this.checkOption2("useCommandThread","-threaded");this.setStartupBooleans();this.setIntProperty("_nProcessors",JV.Viewer.nProcessors);this.isSilent||JU.Logger.info("(C) 2015 Jmol Development\nJmol Version: "+JV.Viewer.getJmolVersion()+"\njava.vendor: "+JV.Viewer.strJavaVendor+"\njava.version: "+JV.Viewer.strJavaVersion+"\nos.name: "+JV.Viewer.strOSName+"\nAccess: "+this.access+"\nmemory: "+this.getP("_memory")+"\nprocessors available: "+JV.Viewer.nProcessors+"\nuseCommandThread: "+
this.useCommandThread+(!this.isApplet?"":"\nappletId:"+this.htmlName+(this.isSignedApplet?" (signed)":"")));this.zap(!1,!0,!1);this.g.setO("language",J.i18n.GT.getLanguage());this.g.setO("_hoverLabel",this.hoverLabel);this.stm.setJmolDefaults();JU.Elements.covalentVersion=1;this.allowArrayDotNotation=!0;this.allowScripting&&this.getScriptManager()},"java.util.Map");c(c$,"setMaximumSize",function(a){this.maximumSize=Math.max(a,100)},"~N");c(c$,"setStereo",function(a,b){this.isStereoSlave=a;this.gRight=
b},"~B,~O");c(c$,"getMenu",function(a){this.getPopupMenu();return a.equals("\x00")?(this.popupMenu(this.screenWidth-120,0,"j"),"OK"):null==this.jmolpopup?"":this.jmolpopup.jpiGetMenuAsString("Jmol version "+JV.Viewer.getJmolVersion()+"|_GET_MENU|"+a)},"~S");j(c$,"resizeInnerPanel",function(a,b){if(!this.autoExit&&this.haveDisplay)return this.sm.resizeInnerPanel(a,b);this.setScreenDimension(a,b);return B(-1,[this.screenWidth,this.screenHeight])},"~N,~N");j(c$,"setScreenDimension",function(a,b){b=Math.min(b,
this.maximumSize);a=Math.min(a,this.maximumSize);this.tm.stereoDoubleFull&&(a=w((a+1)/2));this.screenWidth==a&&this.screenHeight==b||this.resizeImage(a,b,!1,!1,!0)},"~N,~N");c(c$,"resizeImage",function(a,b,c,g,f){if(c||!this.creatingImage){var e=this.antialiased;this.antialiased=f?this.g.antialiasDisplay&&this.checkMotionRendering(603979786):c&&!g?this.g.antialiasImages:!1;!g&&(!c&&(0<a||e!=this.antialiased))&&this.setShapeProperty(5,"clearBoxes",null);this.imageFontScaling=(this.antialiased?2:1)*
(f||this.tm.scale3D||0>=a?1:1*(this.g.zoomLarge==b>a?b:a)/this.getScreenDim());0<a?(this.screenWidth=a,this.screenHeight=b,c||(this.g.setI("_width",a),this.g.setI("_height",b))):(a=0==this.screenWidth?this.screenWidth=500:this.screenWidth,b=0==this.screenHeight?this.screenHeight=500:this.screenHeight);this.tm.setScreenParameters(a,b,c||f?this.g.zoomLarge:!1,this.antialiased,!1,!1);this.gdata.setWindowParameters(a,b,this.antialiased);0<a&&!c&&this.setStatusResized(a,b)}},"~N,~N,~B,~B,~B");j(c$,"getScreenWidth",
function(){return this.screenWidth});j(c$,"getScreenHeight",function(){return this.screenHeight});c(c$,"getScreenDim",function(){return this.g.zoomLarge==this.screenHeight>this.screenWidth?this.screenHeight:this.screenWidth});c(c$,"setWidthHeightVar",function(){this.g.setI("_width",this.screenWidth);this.g.setI("_height",this.screenHeight)});c(c$,"getBoundBoxCenterX",function(){return w(this.screenWidth/2)});c(c$,"getBoundBoxCenterY",function(){return w(this.screenHeight/2)});c(c$,"updateWindow",
function(a,b){if(!this.refreshing||this.creatingImage)return this.refreshing?!1:!JV.Viewer.isJS;(this.isTainted||this.tm.slabEnabled)&&this.setModelVisibility();this.isTainted=!1;null!=this.rm&&0!=a&&this.setScreenDimension(a,b);return!0},"~N,~N");c(c$,"getImage",function(a,b){var c=null;try{this.beginRendering(a,b),this.render(),this.gdata.endRendering(),c=this.gdata.getScreenImage(b)}catch(g){if(H(g,Error))this.gdata.getScreenImage(b),this.handleError(g,!1),this.setErrorMessage("Error during rendering: "+
g,null);else if(H(g,Exception))System.out.println("render error"+g);else throw g;}return c},"~B,~B");c(c$,"beginRendering",function(a,b){this.gdata.beginRendering(this.tm.getStereoRotationMatrix(a),this.g.translucent,b,!this.checkMotionRendering(603979967))},"~B,~B");c(c$,"render",function(){if(!(null==this.mm.modelSet||!this.mustRender||!this.refreshing&&!this.creatingImage||null==this.rm)){var a=this.antialiased&&this.g.antialiasTranslucent,b=this.shm.finalizeAtoms(this.tm.bsSelectedAtoms,!0);this.isWebGL?
(this.rm.renderExport(this.gdata,this.ms,this.jsParams),this.notifyViewerRepaintDone()):(this.rm.render(this.gdata,this.ms,!0,b),this.gdata.setPass2(a)&&(this.tm.setAntialias(a),this.rm.render(this.gdata,this.ms,!1,null),this.tm.setAntialias(this.antialiased)))}});c(c$,"drawImage",function(a,b,c,g,f){null!=a&&null!=b&&this.apiPlatform.drawImage(a,b,c,g,this.screenWidth,this.screenHeight,f);this.gdata.releaseScreenImage()},"~O,~O,~N,~N,~B");c(c$,"getScreenImage",function(){return this.getScreenImageBuffer(null,
!0)});j(c$,"getScreenImageBuffer",function(a,b){if(this.isWebGL)return b?this.apiPlatform.allocateRgbImage(0,0,null,0,!1,!0):null;var c=this.tm.stereoDoubleFull||this.tm.stereoDoubleDTI,g=this.tm.stereoMode.isBiColor(),f=null==a&&c;g?(this.beginRendering(!0,b),this.render(),this.gdata.endRendering(),this.gdata.snapshotAnaglyphChannelBytes(),this.beginRendering(!1,b),this.render(),this.gdata.endRendering(),this.gdata.applyAnaglygh(this.tm.stereoMode,this.tm.stereoColors),g=this.gdata.getScreenImage(b)):
g=this.getImage(c,b);var e=null;f&&(e=this.apiPlatform.newBufferedImage(g,this.tm.stereoDoubleDTI?this.screenWidth:this.screenWidth<<1,this.screenHeight),a=this.apiPlatform.getGraphics(e));null!=a&&(c&&(this.tm.stereoMode===J.c.STER.DTI?(this.drawImage(a,g,this.screenWidth>>1,0,!0),g=this.getImage(!1,!1),this.drawImage(a,g,0,0,!0),a=null):(this.drawImage(a,g,this.screenWidth,0,!1),g=this.getImage(!1,!1))),null!=a&&this.drawImage(a,g,0,0,!1));return f?e:g},"~O,~B");c(c$,"evalStringWaitStatusQueued",
function(a,b,c,g,f){return 0==b.indexOf("JSCONSOLE")?(this.html5Applet._showInfo(0>b.indexOf("CLOSE")),0<=b.indexOf("CLEAR")&&this.html5Applet._clearConsole(),null):null==this.getScriptManager()?null:this.scm.evalStringWaitStatusQueued(a,b,c,g,f)},"~S,~S,~S,~B,~B");c(c$,"popupMenu",function(a,b,c){if(this.haveDisplay&&this.refreshing&&!this.isPreviewOnly&&!this.g.disablePopupMenu)switch(c){case "j":try{this.getPopupMenu(),this.jmolpopup.jpiShow(a,b)}catch(g){JU.Logger.info(g.toString()),this.g.disablePopupMenu=
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"j"):null,null==this.jmolpopup))return this.async||(this.g.disablePopupMenu=!0),null;this.isJSNoAWT&&this.checkMenuUpdate();return this.jmolpopup.jpiGetMenuAsObject()});j(c$,"setMenu",function(a,b){b&&JU.Logger.info("Setting menu "+(0==a.length?"to Jmol defaults":"from file "+a));0==a.length?a=null:b&&(a=this.getFileAsString3(a,!1,null));this.getProperty("DATA_API","setMenu",a);this.sm.setCallbackFunction("menu",a)},"~S,~B");c(c$,"setStatusFrameChanged",function(a){a&&(this.prevFrame=-2147483648);
this.tm.setVibrationPeriod(NaN);var b=this.am.firstFrameIndex,c=this.am.lastFrameIndex,g=this.am.isMovie;a=this.am.cmi;b==c&&!g&&(a=b);var f=this.getModelFileNumber(a),e=this.am.cmi,h=f,j=f%1E6,l=g?b:this.getModelFileNumber(b),n=g?c:this.getModelFileNumber(c),m;g?m=""+(e+1):0==h?(m=this.getModelNumberDotted(b),b!=c&&(m+=" - "+this.getModelNumberDotted(c)),w(l/1E6)==w(n/1E6)&&(h=l)):m=this.getModelNumberDotted(a);0!=h&&(h=1E6>h?1:w(h/1E6));g||(this.g.setI("_currentFileNumber",h),this.g.setI("_currentModelNumberInFile",
j));b=this.am.currentMorphModel;this.g.setI("_currentFrame",e);this.g.setI("_morphCount",this.am.morphCount);this.g.setF("_currentMorphFrame",b);this.g.setI("_frameID",f);this.g.setI("_modelIndex",a);this.g.setO("_modelNumber",m);this.g.setO("_modelName",0>a?"":this.getModelName(a));f=0>a?"":this.ms.getModelTitle(a);this.g.setO("_modelTitle",null==f?"":f);this.g.setO("_modelFile",0>a?"":this.ms.getModelFileName(a));this.g.setO("_modelType",0>a?"":this.ms.getModelFileType(a));e==this.prevFrame&&b==
this.prevMorphModel||(this.prevFrame=e,this.prevMorphModel=b,f=this.getModelName(e),g?f=""+(""===f?e+1:this.am.caf+1)+": "+f:(g=""+this.getModelNumberDotted(e),f.equals(g)||(f=g+": "+f)),this.sm.setStatusFrameChanged(h,j,0>this.am.animationDirection?-l:l,0>this.am.currentDirection?-n:n,e,b,f),this.doHaveJDX()&&this.getJSV().setModel(a),JV.Viewer.isJS&&this.updateJSView(a,-1))},"~B,~B");c(c$,"doHaveJDX",function(){return this.haveJDX||(this.haveJDX=this.getBooleanProperty("_jspecview"))});c(c$,"getJSV",
function(){null==this.jsv&&(this.jsv=J.api.Interface.getOption("jsv.JSpecView",this,"script"),this.jsv.setViewer(this));return this.jsv});c(c$,"getJDXBaseModelIndex",function(a){return!this.doHaveJDX()?a:this.getJSV().getBaseModelIndex(a)},"~N");c(c$,"getJspecViewProperties",function(a){a=this.sm.getJspecViewProperties(""+a);null!=a&&(this.haveJDX=!0);return a},"~O");c(c$,"scriptEcho",function(a){JU.Logger.isActiveLevel(4)&&(JV.Viewer.isJS&&System.out.println(a),this.sm.setScriptEcho(a,this.isScriptQueued()),
this.listCommands&&(null!=a&&0==a.indexOf("$["))&&JU.Logger.info(a))},"~S");c(c$,"isScriptQueued",function(){return null!=this.scm&&this.scm.isScriptQueued()});c(c$,"notifyError",function(a,b,c){this.g.setO("_errormessage",c);this.sm.notifyError(a,b,c)},"~S,~S,~S");c(c$,"jsEval",function(a){return""+this.sm.jsEval(a)},"~S");c(c$,"jsEvalSV",function(a){return JS.SV.getVariable(JV.Viewer.isJS?this.sm.jsEval(a):this.jsEval(a))},"~S");c(c$,"setFileLoadStatus",function(a,b,c,g,f,e){this.setErrorMessage(f,
null);this.g.setI("_loadPoint",a.getCode());var h=a!==J.c.FIL.CREATING_MODELSET;h&&this.setStatusFrameChanged(!1,!1);this.sm.setFileLoadStatus(b,c,g,f,a.getCode(),h,e);h&&(this.doHaveJDX()&&this.getJSV().setModel(this.am.cmi),JV.Viewer.isJS&&this.updateJSView(this.am.cmi,-2))},"J.c.FIL,~S,~S,~S,~S,Boolean");c(c$,"getZapName",function(){return this.g.modelKitMode?"Jmol Model Kit":"zapped"});c(c$,"setStatusMeasuring",function(a,b,c,g){this.sm.setStatusMeasuring(a,b,c,g)},"~S,~N,~S,~N");c(c$,"notifyMinimizationStatus",
function(){var a=this.getP("_minimizationStep"),b=this.getP("_minimizationForceField");this.sm.notifyMinimizationStatus(this.getP("_minimizationStatus"),n(a,String)?Integer.$valueOf(0):a,this.getP("_minimizationEnergy"),a.toString().equals("0")?Float.$valueOf(0):this.getP("_minimizationEnergyDiff"),b)});c(c$,"setStatusAtomPicked",function(a,b,c,g){g&&this.setSelectionSet(JU.BSUtil.newAndSetBit(a));null==b&&(b=this.g.pickLabel,b=0==b.length?this.getAtomInfoXYZ(a,this.g.messageStyleChime):this.ms.getAtomInfo(a,
b,this.ptTemp));this.setPicked(a,!1);0>a&&(g=this.getPendingMeasurement(),null!=g&&(b=b.substring(0,b.length-1)+',"'+g.getString()+'"]'));this.g.setO("_pickinfo",b);this.sm.setStatusAtomPicked(a,b,c);0>a||(1==this.sm.getSyncMode()&&this.doHaveJDX()&&this.getJSV().atomPicked(a),JV.Viewer.isJS&&this.updateJSView(this.ms.at[a].mi,a))},"~N,~S,java.util.Map,~B");j(c$,"getProperty",function(a,b,c){if(!"DATA_API".equals(a))return this.getPropertyManager().getProperty(a,b,c);switch("scriptCheck.........consoleText.........scriptEditor........scriptEditorState...getAppConsole.......getScriptEditor.....setMenu.............spaceGroupInfo......disablePopupMenu....defaultDirectory....getPopupMenu........shapeManager........getPreference.......".indexOf(b)){case 0:return this.scriptCheckRet(c,
!0);case 20:return null==this.appConsole?"":this.appConsole.getText();case 40:return this.showEditor(c),null;case 60:return this.scriptEditorVisible=c.booleanValue(),null;case 80:return this.$isKiosk?this.appConsole=null:n(c,J.api.JmolAppConsoleInterface)?this.appConsole=c:null!=c&&!c.booleanValue()?this.appConsole=null:null==this.appConsole&&(null!=c&&c.booleanValue())&&(JV.Viewer.isJS&&(this.appConsole=J.api.Interface.getOption("consolejs.AppletConsole",this,"script")),null!=this.appConsole&&this.appConsole.start(this)),
this.scriptEditor=JV.Viewer.isJS||null==this.appConsole?null:this.appConsole.getScriptEditor(),this.appConsole;case 100:return null==this.appConsole&&(null!=c&&c.booleanValue())&&(this.getProperty("DATA_API","getAppConsole",Boolean.TRUE),this.scriptEditor=null==this.appConsole?null:this.appConsole.getScriptEditor()),this.scriptEditor;case 120:return null!=this.jmolpopup&&this.jmolpopup.jpiDispose(),this.jmolpopup=null,this.menuStructure=c;case 140:return this.getSymTemp().getSpaceGroupInfo(this.ms,
null,-1,!1,null);case 160:return this.g.disablePopupMenu=!0,null;case 180:return this.g.defaultDirectory;case 200:return n(c,String)?this.getMenu(c):this.getPopupMenu();case 220:return this.shm.getProperty(c);case 240:return this.sm.syncSend("getPreference",c,1)}JU.Logger.error("ERROR in getProperty DATA_API: "+b);return null},"~S,~S,~O");c(c$,"notifyMouseClicked",function(a,b,c,g){var f=JV.binding.Binding.getButtonMods(c),e=JV.binding.Binding.getClickCount(c);this.g.setI("_mouseX",a);this.g.setI("_mouseY",
this.screenHeight-b);this.g.setI("_mouseAction",c);this.g.setI("_mouseModifiers",f);this.g.setI("_clickCount",e);return this.sm.setStatusClicked(a,this.screenHeight-b,c,e,g)},"~N,~N,~N,~N");c(c$,"getOutputManager",function(){return null!=this.outputManager?this.outputManager:(this.outputManager=J.api.Interface.getInterface("JV.OutputManager"+(JV.Viewer.isJS?"JS":"Awt"),this,"file")).setViewer(this,this.privateKey)});c(c$,"getJzt",function(){return null==this.jzt?this.jzt=J.api.Interface.getInterface("JU.ZipTools",
this,"zip"):this.jzt});c(c$,"readFileAsMap",function(a,b,c){this.getJzt().readFileAsMap(a,b,c)},"java.io.BufferedInputStream,java.util.Map,~S");c(c$,"getZipDirectoryAsString",function(a){a=this.fm.getBufferedInputStreamOrErrorMessageFromName(a,a,!1,!1,null,!1,!0);return this.getJzt().getZipDirectoryAsStringAndClose(a)},"~S");j(c$,"getImageAsBytes",function(a,b,c,g,f){return this.getOutputManager().getImageAsBytes(a,b,c,g,f)},"~S,~N,~N,~N,~A");j(c$,"releaseScreenImage",function(){this.gdata.releaseScreenImage()});
c(c$,"setDisplay",function(a){this.display=a;this.apiPlatform.setViewer(this,a)},"~O");c(c$,"newMeasurementData",function(a,b){return J.api.Interface.getInterface("JM.MeasurementData",this,"script").init(a,this,b)},"~S,JU.Lst");c(c$,"getDataManager",function(){return null==this.dm?this.dm=J.api.Interface.getInterface("JV.DataManager",this,"script").set(this):this.dm});c(c$,"getScriptManager",function(){if(this.allowScripting&&null==this.scm){this.scm=J.api.Interface.getInterface("JS.ScriptManager",
this,"setOptions");if(JV.Viewer.isJS&&null==this.scm)throw new NullPointerException;if(null==this.scm)return this.allowScripting=!1,null;this.eval=this.scm.setViewer(this);this.useCommandThread&&this.scm.startCommandWatcher(!0)}return this.scm});c(c$,"checkOption2",function(a,b){return this.vwrOptions.containsKey(a)&&!this.vwrOptions.get(a).toString().equals("false")||0<=this.commandOptions.indexOf(b)},"~S,~S");c(c$,"setStartupBooleans",function(){this.setBooleanProperty("_applet",this.isApplet);
this.setBooleanProperty("_jspecview",!1);this.setBooleanProperty("_signedApplet",this.isSignedApplet);this.setBooleanProperty("_headless",this.headless);this.setStringProperty("_restrict",'"'+this.access+'"');this.setBooleanProperty("_useCommandThread",this.useCommandThread)});c(c$,"getExportDriverList",function(){return this.haveAccess(JV.Viewer.ACCESS.ALL)?this.g.getParameter("exportDrivers",!0):""});j(c$,"dispose",function(){this.gRight=null;null!=this.mouse&&(this.acm.dispose(),this.mouse.dispose(),
this.mouse=null);this.clearScriptQueue();this.clearThreads();this.haltScriptExecution();null!=this.scm&&this.scm.clear(!0);this.gdata.destroy();null!=this.jmolpopup&&this.jmolpopup.jpiDispose();null!=this.modelkit&&this.modelkit.dispose();try{null!=this.appConsole&&(this.appConsole.dispose(),this.appConsole=null),null!=this.scriptEditor&&(this.scriptEditor.dispose(),this.scriptEditor=null)}catch(a){if(!H(a,Exception))throw a;}});c(c$,"reset",function(a){this.ms.calcBoundBoxDimensions(null,1);this.axesAreTainted=
!0;this.tm.homePosition(a);this.ms.setCrystallographicDefaults()?this.stm.setCrystallographicDefaults():this.setAxesMode(603979809);this.prevFrame=-2147483648;this.tm.spinOn||this.setSync()},"~B");j(c$,"homePosition",function(){this.evalString("reset spin")});c(c$,"initialize",function(a,b){this.g=new JV.GlobalSettings(this,this.g,a);this.setStartupBooleans();this.setWidthHeightVar();this.haveDisplay&&(this.g.setB("_is2D",JV.Viewer.isJS&&!this.isWebGL),this.g.setB("_multiTouchClient",this.acm.isMTClient()),
this.g.setB("_multiTouchServer",this.acm.isMTServer()));this.cm.setDefaultColors(!1);this.setObjectColor("background","black");this.setObjectColor("axis1","red");this.setObjectColor("axis2","green");this.setObjectColor("axis3","blue");this.am.setAnimationOn(!1);this.am.setAnimationFps(this.g.animationFps);this.sm.playAudio(null);this.sm.allowStatusReporting=this.g.statusReporting;this.setBooleanProperty("antialiasDisplay",b?!0:this.g.antialiasDisplay);this.stm.resetLighting();this.tm.setDefaultPerspective()},
"~B,~B");c(c$,"saveModelOrientation",function(){this.ms.saveModelOrientation(this.am.cmi,this.stm.getOrientation())});c(c$,"restoreModelOrientation",function(a){a=this.ms.getModelOrientation(a);null!=a&&a.restore(-1,!0)},"~N");c(c$,"restoreModelRotation",function(a){a=this.ms.getModelOrientation(a);null!=a&&a.restore(-1,!1)},"~N");c(c$,"getGLmolView",function(){var a=this.tm,b=a.fixedRotationCenter,c=a.getRotationQ();return{center:b,quaternion:c,xtrans:a.xTranslationFraction,ytrans:a.yTranslationFraction,
scale:a.scalePixelsPerAngstrom,zoom:a.zmPctSet,cameraDistance:a.cameraDistance,pixelCount:a.screenPixelCount,perspective:a.perspectiveDepth,width:a.width,height:a.height}});c(c$,"setRotationRadius",function(a,b){b&&(a=this.tm.setRotationRadius(a,!1));this.ms.setRotationRadius(this.am.cmi,a)&&this.g.setF("rotationRadius",a)},"~N,~B");c(c$,"setCenterBitSet",function(a,b){this.isJmolDataFrame()||this.tm.setNewRotationCenter(0<JU.BSUtil.cardinalityOf(a)?this.ms.getAtomSetCenter(a):null,b)},"JU.BS,~B");
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f));if(0!=l)return this.fm.setFileInfo(m),this.loadAtomDataAndReturnError(j,l);if(e.containsKey("isData"))return j;null!=h&&!n(j,String)&&(b=e.get("fullPathName"),null==b&&(b=""),e.containsKey("loadScript")&&(h=e.get("loadScript")),e.put("loadScript",h=(new JU.SB).append(JU.PT.rep(h.toString(),"$FILENAME$",JU.PT.esc(JV.FileManager.fixDOSName(b))))));return this.createModelSetAndReturnError(j,f,h,e)},"~S,~S,~A,~O,~B,java.util.Map,JU.SB,JU.SB,~N,~S");c(c$,"setLigandModel",function(a,b){null==this.ligandModels&&
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1):0<=b.indexOf("\\")&&(b=b.substring(0,b.lastIndexOf("\\")+1));a=b+a}JU.Logger.info("showUrl:"+a);this.sm.showUrl(a)}},"~S");c(c$,"setMeshCreator",function(a){this.shm.loadShape(24);this.setShapeProperty(24,"meshCreator",a)},"~O");c(c$,"showConsole",function(a){if(this.haveDisplay)try{null==this.appConsole&&a&&this.getConsole(),this.appConsole.setVisible(!0)}catch(b){}},"~B");c(c$,"getConsole",function(){this.getProperty("DATA_API","getAppConsole",Boolean.TRUE);return this.appConsole});j(c$,"getParameter",
function(a){return this.getP(a)},"~S");c(c$,"getP",function(a){return this.g.getParameter(a,!0)},"~S");c(c$,"getPOrNull",function(a){return this.g.getParameter(a,!1)},"~S");c(c$,"unsetProperty",function(a){a=a.toLowerCase();(a.equals("all")||a.equals("variables"))&&this.fm.setPathForAllFiles("");this.g.unsetUserVariable(a)},"~S");j(c$,"notifyStatusReady",function(a){System.out.println("Jmol applet "+this.fullName+(a?" ready":" destroyed"));a||this.dispose();this.sm.setStatusAppletReady(this.fullName,
a)},"~B");j(c$,"getBooleanProperty",function(a){a=a.toLowerCase();if(this.g.htBooleanParameterFlags.containsKey(a))return this.g.htBooleanParameterFlags.get(a).booleanValue();if(a.endsWith("p!")){if(null==this.acm)return!1;var b=this.acm.getPickingState().toLowerCase();a=a.substring(0,a.length-2)+";";return 0<=b.indexOf(a)}if(a.equalsIgnoreCase("executionPaused"))return null!=this.eval&&this.eval.isPaused();if(a.equalsIgnoreCase("executionStepping"))return null!=this.eval&&this.eval.isStepping();
if(a.equalsIgnoreCase("haveBFactors"))return null!=this.ms.getBFactors();if(a.equalsIgnoreCase("colorRasmol"))return this.cm.isDefaultColorRasmol;if(a.equalsIgnoreCase("frank"))return this.getShowFrank();if(a.equalsIgnoreCase("spinOn"))return this.tm.spinOn;if(a.equalsIgnoreCase("isNavigating"))return this.tm.isNavigating();if(a.equalsIgnoreCase("showSelections"))return this.selectionHalosEnabled;if(this.g.htUserVariables.containsKey(a)){b=this.g.getUserVariable(a);if(1073742335==b.tok)return!0;if(1073742334==
b.tok)return!1}JU.Logger.error("vwr.getBooleanProperty("+a+") - unrecognized");return!1},"~S");j(c$,"getInt",function(a){switch(a){case 553648132:return this.am.animationFps;case 553648141:return this.g.dotDensity;case 553648142:return this.g.dotScale;case 553648144:return this.g.helixStep;case 553648147:return this.g.infoFontSize;case 553648150:return this.g.meshScale;case 553648153:return this.g.minPixelSelRadius;case 553648154:return this.g.percentVdwAtom;case 553648157:return this.g.pickingSpinRate;
case 553648166:return this.g.ribbonAspectRatio;case 536870922:return this.g.scriptDelay;case 553648152:return this.g.minimizationMaxAtoms;case 553648170:return this.g.smallMoleculeMaxAtoms;case 553648184:return this.g.strutSpacing;case 553648185:return this.g.vectorTrail}JU.Logger.error("viewer.getInt("+JS.T.nameOf(a)+") - not listed");return 0},"~N");c(c$,"getDelayMaximumMs",function(){return this.haveDisplay?this.g.delayMaximumMs:1});c(c$,"getHermiteLevel",function(){return this.tm.spinOn&&0<this.g.hermiteLevel?
0:this.g.hermiteLevel});c(c$,"getHoverDelay",function(){return this.g.modelKitMode?20:this.g.hoverDelayMs});j(c$,"getBoolean",function(a){switch(a){case 603979891:return this.g.nboCharges;case 603979856:return this.g.hiddenLinesDashed;case 1073742086:return this.ms.getMSInfoB("isPDB");case 603979802:return this.g.autoplayMovie;case 603979797:return!this.headless&&this.g.allowAudio;case 603979780:return this.g.allowGestures;case 603979784:return this.g.allowMultiTouch;case 603979785:return this.g.allowRotateSelected;
case 603979792:return this.g.appendNew;case 603979794:return this.g.applySymmetryToBonds;case 603979796:return this.g.atomPicking;case 603979798:return this.g.autoBond;case 603979800:return this.g.autoFps;case 603979806:return this.g.axesOrientationRasmol;case 603979811:return this.g.cartoonSteps;case 603979810:return this.g.cartoonBlocks;case 603979821:return this.g.checkCIR;case 603979812:return this.g.bondModeOr;case 603979815:return this.g.cartoonBaseEdges;case 603979816:return this.g.cartoonFancy;
case 603979817:return this.g.cartoonLadders;case 603979818:return this.g.cartoonRibose;case 603979819:return this.g.cartoonRockets;case 603979822:return this.g.chainCaseSensitive||this.chainCaseSpecified;case 603979823:return this.g.cipRule6Full;case 603979825:return this.g.debugScript;case 603979826:return this.g.defaultStructureDSSP;case 603979827:return this.g.disablePopupMenu;case 603979828:return this.g.displayCellParameters;case 603979830:return this.g.dotSurface;case 603979829:return this.g.dotsSelectedOnly;
case 603979833:return this.g.drawPicking;case 603979844:return this.g.fontCaching;case 603979845:return this.g.fontScaling;case 603979846:return this.g.forceAutoBond;case 603979848:return!1;case 603979850:return this.g.greyscaleRendering;case 603979852:return this.g.hbondsBackbone;case 603979853:return this.g.hbondsRasmol;case 603979854:return this.g.hbondsSolid;case 1612709894:return this.g.rasmolHeteroSetting;case 603979858:return this.g.hideNameInPopup;case 603979864:return this.g.highResolutionFlag;
case 1612709900:return this.g.rasmolHydrogenSetting;case 603979867:return this.g.isosurfaceKey;case 603979869:return this.g.jmolInJSpecView;case 603979870:return this.g.justifyMeasurements;case 603979872:return this.g.legacyAutoBonding;case 603979873:return this.g.legacyHAddition;case 603979874:return this.g.legacyJavaFloat;case 603979876:return this.g.logGestures;case 603979877:return this.g.measureAllModels;case 603979878:return this.g.measurementLabels;case 603979879:return this.g.messageStyleChime;
case 603983903:return this.g.modelKitMode;case 603979886:return this.g.multipleBondBananas;case 603979889:return this.g.navigationMode;case 603979890:return this.g.navigationPeriodic;case 603979893:return this.g.partialDots;case 603979894:return this.g.pdbAddHydrogens;case 603979896:return this.g.pdbSequential;case 603979898:return this.g.preserveState;case 603979900:return this.refreshing;case 603979901:return this.g.ribbonBorder;case 603979902:return this.g.rocketBarrels;case 603979892:return this.g.noDelay;
case 603979906:return this.g.selectAllModels;case 603979920:return this.g.showHiddenSelectionHalos;case 603979922:return this.g.showHydrogens;case 603979926:return this.g.showMeasurements;case 603979927:return this.g.showModVecs;case 603979928:return this.g.showMultipleBonds;case 603979934:return this.g.showTiming;case 603979937:return this.g.showUnitCellDetails;case 603979939:return this.g.slabByAtom;case 603979940:return this.g.slabByMolecule;case 603979944:return this.g.smartAromatic;case 603979948:return this.g.dotSolvent;
case 603979952:return this.g.ssbondsBackbone;case 603979955:return this.g.strutsMultiple;case 603979960:return this.g.testFlag1;case 603979962:return this.g.testFlag2;case 603979964:return this.g.testFlag3;case 603979965:return this.g.testFlag4;case 603979966:return this.g.traceAlpha;case 603979967:return this.g.translucent;case 603979968:return this.g.twistedSheets;case 603979972:return this.g.vectorsCentered;case 603979973:return this.g.vectorSymmetry;case 603979975:return this.g.waitForMoveTo;
case 603979978:return this.g.zeroBasedXyzRasmol}JU.Logger.error("viewer.getBoolean("+JS.T.nameOf(a)+") - not listed");return!1},"~N");c(c$,"allowEmbeddedScripts",function(){return this.g.allowEmbeddedScripts&&!this.isPreviewOnly});c(c$,"getDragSelected",function(){return this.g.dragSelected&&!this.g.modelKitMode});c(c$,"getBondsPickable",function(){return this.g.bondPicking||this.g.modelKitMode&&this.getModelkitProperty("isMolecular")===Boolean.TRUE});c(c$,"useMinimizationThread",function(){return this.g.useMinimizationThread&&
!this.autoExit});j(c$,"getFloat",function(a){switch(a){case 1140850689:return this.g.particleRadius;case 570425345:return this.g.axesOffset;case 570425346:return this.g.axesScale;case 570425348:return this.g.bondTolerance;case 570425353:return this.g.defaultTranslucent;case 570425352:return this.g.defaultDrawArrowScale;case 570425354:return this.g.dipoleScale;case 570425355:return this.g.drawFontSize;case 570425357:return this.g.exportScale;case 570425359:return this.g.hbondsAngleMinimum;case 570425361:return this.g.hbondHXDistanceMaximum;
case 570425360:return this.g.hbondNODistanceMaximum;case 570425363:return this.g.loadAtomDataTolerance;case 570425364:return this.g.minBondDistance;case 1275072532:return this.g.modulationScale;case 570425370:return this.g.multipleBondSpacing;case 570425369:return this.g.multipleBondRadiusFactor;case 570425374:return this.g.navigationSpeed;case 570425382:return this.g.pointGroupDistanceTolerance;case 570425384:return this.g.pointGroupLinearTolerance;case 570425388:return this.tm.modelRadius;case 570425392:return this.g.sheetSmoothing;
case 570425394:return this.g.solventProbeRadius;case 570425403:return this.g.starWidth;case 570425406:return this.g.strutDefaultRadius;case 570425408:return this.g.strutLengthMaximum;case 1648361473:return this.g.vectorScale;case 570425412:return this.g.vibrationPeriod;case 570425347:return this.g.cartoonBlockHeight}JU.Logger.error("viewer.getFloat("+JS.T.nameOf(a)+") - not listed");return 0},"~N");j(c$,"setStringProperty",function(a,b){if(!(null==b||null==a||0==a.length))if("_"==a.charAt(0))this.g.setO(a,
b);else{var c=JS.T.getTokFromName(a);switch(JS.T.getParamType(c)){case 603979776:this.setBooleanPropertyTok(a,c,JS.SV.newV(4,b).asBoolean());break;case 553648128:this.setIntPropertyTok(a,c,JS.SV.newV(4,b).asInt());break;case 570425344:this.setFloatPropertyTok(a,c,JU.PT.parseFloat(b));break;default:this.setStringPropertyTok(a,c,b)}}},"~S,~S");c(c$,"setStringPropertyTok",function(a,b,c){switch(b){case 545259567:this.g.macroDirectory=c=null==c||0==c.length?"https://chemapps.stolaf.edu/jmol/macros":c;
this.macros=null;break;case 545259570:this.g.nihResolverFormat=c;break;case 545259521:this.setAnimationMode(c);return;case 545259569:this.g.nmrPredictFormat=c;break;case 545259548:this.g.defaultDropScript=c;break;case 545259572:c=this.fm.setPathForAllFiles(c);break;case 545259558:this.setUnits(c,!1);return;case 545259560:this.g.forceField=c="UFF".equalsIgnoreCase(c)?"UFF":"UFF2D".equalsIgnoreCase(c)?"UFF2D":"MMFF2D".equalsIgnoreCase(c)?"MMFF2D":"MMFF";this.minimizer=null;break;case 545259571:this.g.nmrUrlFormat=
c;break;case 545259568:this.setUnits(c,!0);return;case 545259565:this.g.pdbLoadLigandFormat=c;break;case 545259543:this.g.defaultLabelPDB=c;break;case 545259544:this.g.defaultLabelXYZ=c;break;case 545259549:this.g.defaultLoadFilter=c;break;case 545259566:c=this.getOutputManager().setLogFile(c);if(null==c)return;break;case 545259559:break;case 545259524:this.g.atomTypes=c;break;case 545259538:break;case 545259576:this.g.pickLabel=c;break;case 545259580:this.g.quaternionFrame=2==c.length&&c.startsWith("R")?
c.substring(0,2):""+(c.toLowerCase()+"p").charAt(0);JU.PT.isOneOf(this.g.quaternionFrame,"RC;RP;a;b;c;n;p;q;x;")||(this.g.quaternionFrame="p");this.ms.haveStraightness=!1;break;case 545259555:this.setVdwStr(c);return;case 545259563:new J.i18n.GT(this,c);b=J.i18n.GT.getLanguage();this.modelkit=null;null!=this.jmolpopup&&(this.jmolpopup.jpiDispose(),this.jmolpopup=null,this.getPopupMenu());this.sm.setCallbackFunction("language",b);c=J.i18n.GT.getLanguage();break;case 545259564:this.g.loadFormat=c;break;
case 545259534:this.setObjectColor("background",c);return;case 545259528:this.setObjectColor("axis1",c);return;case 545259530:this.setObjectColor("axis2",c);return;case 545259532:this.setObjectColor("axis3",c);return;case 545259536:this.setObjectColor("boundbox",c);return;case 545259586:this.setObjectColor("unitcell",c);return;case 545259578:this.setPropertyColorScheme(c,!1,!1);break;case 545259562:this.shm.loadShape(35);this.setShapeProperty(35,"atomLabel",c);break;case 545259547:this.g.defaultDistanceLabel=
c;break;case 545259542:this.g.defaultAngleLabel=c;break;case 545259554:this.g.defaultTorsionLabel=c;break;case 545259550:this.g.defaultLoadScript=c;break;case 545259522:this.fm.setAppletProxy(c);break;case 545259546:null==c&&(c="");c=c.$replace("\\","/");this.g.defaultDirectory=c;break;case 545259561:this.g.helpPath=c;break;case 545259552:!c.equalsIgnoreCase("RasMol")&&!c.equalsIgnoreCase("PyMOL")&&(c="Jmol");this.setDefaultsType(c);break;case 545259545:this.setDefaultColors(c.equalsIgnoreCase("rasmol"));
return;case 545259573:this.setPickingMode(c,0);return;case 545259574:this.setPickingStyle(c,0);return;case 545259540:break;default:if(a.toLowerCase().endsWith("callback")){this.sm.setCallbackFunction(a,0==c.length||c.equalsIgnoreCase("none")?null:c);break}if(!this.g.htNonbooleanParameterValues.containsKey(a.toLowerCase())){this.g.setUserVariable(a,JS.SV.newV(4,c));return}}this.g.setO(a,c)},"~S,~N,~S");j(c$,"setFloatProperty",function(a,b){if(!Float.isNaN(b)&&!(null==a||0==a.length))if("_"==a.charAt(0))this.g.setF(a,
b);else{var c=JS.T.getTokFromName(a);switch(JS.T.getParamType(c)){case 545259520:this.setStringPropertyTok(a,c,""+b);break;case 603979776:this.setBooleanPropertyTok(a,c,0!=b);break;case 553648128:this.setIntPropertyTok(a,c,A(b));break;default:this.setFloatPropertyTok(a,c,b)}}},"~S,~N");c(c$,"setFloatPropertyTok",function(a,b,c){switch(b){case 570425347:this.g.cartoonBlockHeight=c;break;case 570425366:this.ms.setModulation(null,!1,null,!1);this.g.modulationScale=c=Math.max(0.1,c);this.ms.setModulation(null,
!0,null,!1);break;case 570425381:this.g.particleRadius=Math.abs(c);break;case 570425355:this.g.drawFontSize=c;break;case 570425357:this.g.exportScale=c;break;case 570425403:this.g.starWidth=c;break;case 570425369:this.g.multipleBondRadiusFactor=c;break;case 570425370:this.g.multipleBondSpacing=c;break;case 570425393:this.tm.setSlabRange(c);break;case 570425365:this.g.minimizationCriterion=c;break;case 570425358:this.haveDisplay&&this.acm.setGestureSwipeFactor(c);break;case 570425367:this.haveDisplay&&
this.acm.setMouseDragFactor(c);break;case 570425368:this.haveDisplay&&this.acm.setMouseWheelFactor(c);break;case 570425408:this.g.strutLengthMaximum=c;break;case 570425406:this.g.strutDefaultRadius=c;break;case 570425376:this.setSpin("X",A(c));break;case 570425378:this.setSpin("Y",A(c));break;case 570425380:this.setSpin("Z",A(c));break;case 570425371:if(Float.isNaN(c))return;this.setSpin("FPS",A(c));break;case 570425363:this.g.loadAtomDataTolerance=c;break;case 570425359:this.g.hbondsAngleMinimum=
c;break;case 570425361:this.g.hbondHXDistanceMaximum=c;break;case 570425360:this.g.hbondNODistanceMaximum=c;break;case 570425382:this.g.pointGroupDistanceTolerance=c;break;case 570425384:this.g.pointGroupLinearTolerance=c;break;case 570425356:this.g.ellipsoidAxisDiameter=c;break;case 570425398:this.setSpin("x",A(c));break;case 570425400:this.setSpin("y",A(c));break;case 570425402:this.setSpin("z",A(c));break;case 570425396:this.setSpin("fps",A(c));break;case 570425352:this.g.defaultDrawArrowScale=
c;break;case 570425353:this.g.defaultTranslucent=c;break;case 570425345:this.setAxesScale(b,c);break;case 570425346:this.setAxesScale(b,c);break;case 570425416:this.tm.visualRangeAngstroms=c;this.refresh(1,"set visualRange");break;case 570425372:this.setNavigationDepthPercent(c);break;case 570425374:this.g.navigationSpeed=c;break;case 570425373:this.tm.setNavigationSlabOffsetPercent(c);break;case 570425350:this.tm.setCameraDepthPercent(c,!1);this.refresh(1,"set cameraDepth");return;case 570425388:this.setRotationRadius(c,
!0);return;case 570425362:this.g.hoverDelayMs=A(1E3*c);break;case 570425392:this.g.sheetSmoothing=c;break;case 570425354:c=JV.Viewer.checkFloatRange(c,-10,10);this.g.dipoleScale=c;break;case 570425404:this.tm.setStereoDegrees(c);break;case 1648361473:this.setVectorScale(c);return;case 570425412:this.setVibrationPeriod(c);return;case 570425414:this.setVibrationScale(c);return;case 570425348:this.setBondTolerance(c);return;case 570425364:this.setMinBondDistance(c);return;case 570425390:this.tm.setScaleAngstromsPerInch(c);
break;case 570425394:c=JV.Viewer.checkFloatRange(c,0,10);this.g.solventProbeRadius=c;break;default:if(!this.g.htNonbooleanParameterValues.containsKey(a.toLowerCase())){this.g.setUserVariable(a,JS.SV.newF(c));return}}this.g.setF(a,c)},"~S,~N,~N");j(c$,"setIntProperty",function(a,b){if(!(-2147483648==b||null==a||0==a.length))if("_"==a.charAt(0))this.g.setI(a,b);else{var c=JS.T.getTokFromName(a);switch(JS.T.getParamType(c)){case 545259520:this.setStringPropertyTok(a,c,""+b);break;case 603979776:this.setBooleanPropertyTok(a,
c,0!=b);break;case 570425344:this.setFloatPropertyTok(a,c,b);break;default:this.setIntPropertyTok(a,c,b)}}},"~S,~N");c(c$,"setIntPropertyTok",function(a,b,c){switch(b){case 553648152:this.g.minimizationMaxAtoms=c;break;case 553648147:this.g.infoFontSize=Math.max(0,c);break;case 553648167:case 553648146:case 553648168:c=this.eval.setStatic(b,c);break;case 553648185:this.g.vectorTrail=c;break;case 553648138:c=0==c?0:1;this.g.bondingVersion=JU.Elements.bondingVersion=c;break;case 553648137:this.gdata.setCelPower(c);
break;case 553648129:this.gdata.setAmbientOcclusion(c);break;case 553648158:this.g.platformSpeed=Math.min(Math.max(c,0),10);break;case 553648150:this.g.meshScale=c;break;case 553648153:this.g.minPixelSelRadius=c;break;case 553648148:this.g.isosurfacePropertySmoothingPower=c;break;case 553648165:this.g.repaintWaitMs=c;break;case 553648170:this.g.smallMoleculeMaxAtoms=c;break;case 553648151:this.g.minimizationSteps=c;break;case 553648184:this.g.strutSpacing=c;break;case 553648156:c=JV.Viewer.checkIntRange(c,
0,1E3);this.gdata.setPhongExponent(c);break;case 553648144:this.g.helixStep=c;this.ms.haveStraightness=!1;break;case 553648142:this.g.dotScale=c;break;case 553648141:this.g.dotDensity=c;break;case 553648139:this.g.delayMaximumMs=c;break;case 553648149:JU.Logger.setLogLevel(c);JU.Logger.info("logging level set to "+c);this.g.setI("logLevel",c);null!=this.eval&&this.eval.setDebugging();return;case 553648134:this.setAxesMode(2==c?603979808:1==c?603979804:603979809);return;case 553648178:this.setStrandCount(0,
c);return;case 553648182:this.setStrandCount(12,c);return;case 553648180:this.setStrandCount(13,c);return;case 553648155:return;case 536870922:this.g.scriptDelay=c;break;case 553648176:c=0>c?JV.Viewer.checkIntRange(c,-10,-1):JV.Viewer.checkIntRange(c,0,100);this.gdata.setSpecularPower(c);break;case 553648172:c=JV.Viewer.checkIntRange(-c,-10,-1);this.gdata.setSpecularPower(c);break;case 553648136:this.setMarBond(c);return;case 536870924:this.setBooleanPropertyTok(a,b,1==c);return;case 553648174:c=
JV.Viewer.checkIntRange(c,0,100);this.gdata.setSpecularPercent(c);break;case 553648140:c=JV.Viewer.checkIntRange(c,0,100);this.gdata.setDiffusePercent(c);break;case 553648130:c=JV.Viewer.checkIntRange(c,0,100);this.gdata.setAmbientPercent(c);break;case 553648186:this.tm.zDepthToPercent(c);break;case 553648188:this.tm.zSlabToPercent(c);break;case 554176526:this.tm.depthToPercent(c);break;case 554176565:this.tm.slabToPercent(c);break;case 553648190:this.g.zShadePower=c=Math.max(c,0);break;case 553648166:this.g.ribbonAspectRatio=
c;break;case 553648157:this.g.pickingSpinRate=1>c?1:c;break;case 553648132:this.setAnimationFps(c);return;case 553648154:this.setPercentVdwAtom(c);break;case 553648145:this.g.hermiteLevel=c;break;case 553648143:case 553648160:case 553648159:case 553648162:case 553648164:break;default:if(!this.g.htNonbooleanParameterValues.containsKey(a)){this.g.setUserVariable(a,JS.SV.newI(c));return}}this.g.setI(a,c)},"~S,~N,~N");c$.checkIntRange=c(c$,"checkIntRange",function(a,b,c){return a<b?b:a>c?c:a},"~N,~N,~N");
c$.checkFloatRange=c(c$,"checkFloatRange",function(a,b,c){return a<b?b:a>c?c:a},"~N,~N,~N");j(c$,"setBooleanProperty",function(a,b){if(!(null==a||0==a.length))if("_"==a.charAt(0))this.g.setB(a,b);else{var c=JS.T.getTokFromName(a);switch(JS.T.getParamType(c)){case 545259520:this.setStringPropertyTok(a,c,"");break;case 553648128:this.setIntPropertyTok(a,c,b?1:0);break;case 570425344:this.setFloatPropertyTok(a,c,b?1:0);break;default:this.setBooleanPropertyTok(a,c,b)}}},"~S,~B");c(c$,"setBooleanPropertyTok",
function(a,b,c){var g=!0;switch(b){case 603979821:(this.g.checkCIR=c)&&this.checkCIR(!0);break;case 603979823:this.g.cipRule6Full=c;break;case 603979802:this.g.autoplayMovie=c;break;case 603979797:c=!1;this.g.allowAudio=c;break;case 603979892:this.g.noDelay=c;break;case 603979891:this.g.nboCharges=c;break;case 603979856:this.g.hiddenLinesDashed=c;break;case 603979886:this.g.multipleBondBananas=c;break;case 603979884:this.g.modulateOccupancy=c;break;case 603979874:this.g.legacyJavaFloat=c;break;case 603979927:this.g.showModVecs=
c;break;case 603979937:this.g.showUnitCellDetails=c;break;case 603979848:g=!1;break;case 603979972:this.g.vectorsCentered=c;break;case 603979810:this.g.cartoonBlocks=c;break;case 603979811:this.g.cartoonSteps=c;break;case 603979818:this.g.cartoonRibose=c;break;case 603979837:this.g.ellipsoidArrows=c;break;case 603979967:this.g.translucent=c;break;case 603979817:this.g.cartoonLadders=c;break;case 603979968:b=this.g.twistedSheets;this.g.twistedSheets=c;b!=c&&this.checkCoordinatesChanged();break;case 603979820:this.gdata.setCel(c);
break;case 603979816:this.g.cartoonFancy=c;break;case 603979934:this.g.showTiming=c;break;case 603979973:this.g.vectorSymmetry=c;break;case 603979867:this.g.isosurfaceKey=c;break;case 603979893:this.g.partialDots=c;break;case 603979872:this.g.legacyAutoBonding=c;break;case 603979826:this.g.defaultStructureDSSP=c;break;case 603979834:this.g.dsspCalcHydrogen=c;break;case 603979782:(this.g.allowModelkit=c)||this.setModelKitMode(!1);break;case 603983903:this.setModelKitMode(c);break;case 603979887:this.g.multiProcessor=
c&&1<JV.Viewer.nProcessors;break;case 603979885:this.g.monitorEnergy=c;break;case 603979853:this.g.hbondsRasmol=c;break;case 603979880:this.g.minimizationRefresh=c;break;case 603979881:this.g.minimizationSilent=c;break;case 603979866:c&&(this.$isKiosk=!0,this.g.disablePopupMenu=!0,null!=this.display&&this.apiPlatform.setTransparentCursor(this.display));break;case 603979975:this.g.waitForMoveTo=c;break;case 603979875:this.g.logCommands=!0;break;case 603979876:this.g.logGestures=!0;break;case 603979784:this.g.allowMultiTouch=
c;break;case 603979898:this.g.preserveState=c;this.ms.setPreserveState(c);this.undoClear();break;case 603979955:this.g.strutsMultiple=c;break;case 603979842:break;case 603979939:this.g.slabByAtom=c;break;case 603979940:this.g.slabByMolecule=c;break;case 603979903:this.g.saveProteinStructureState=c;break;case 603979780:this.g.allowGestures=c;break;case 603979865:this.g.imageState=c;break;case 603979970:this.g.useMinimizationThread=c;break;case 603979781:this.g.allowKeyStrokes=c;break;case 603979831:this.g.dragSelected=
c;this.showSelected=!1;break;case 603979924:this.g.showKeyStrokes=c;break;case 603979844:this.g.fontCaching=c;break;case 603979796:this.g.atomPicking=c;break;case 603979814:this.highlight(null);this.g.bondPicking=c;break;case 603979906:(this.g.selectAllModels=c)?this.slm.setSelectionSubset(null):this.am.setSelectAllSubset(!1);break;case 603979879:this.g.messageStyleChime=c;break;case 603979896:this.g.pdbSequential=c;break;case 603979894:this.g.pdbAddHydrogens=c;break;case 603979895:this.g.pdbGetHeader=
c;break;case 603979838:this.g.ellipsoidAxes=c;break;case 603979836:this.g.ellipsoidArcs=c;break;case 603979839:this.g.ellipsoidBall=c;break;case 603979840:this.g.ellipsoidDots=c;break;case 603979841:this.g.ellipsoidFill=c;break;case 603979845:this.g.fontScaling=c;break;case 603979956:this.setSyncTarget(0,c);break;case 603979958:this.setSyncTarget(1,c);break;case 603979977:this.g.wireframeRotation=c;break;case 603979868:this.g.isosurfacePropertySmoothing=c;break;case 603979833:this.g.drawPicking=c;
break;case 603979786:case 603979790:case 603979788:this.setAntialias(b,c);break;case 603979944:this.g.smartAromatic=c;break;case 603979794:this.setApplySymmetryToBonds(c);break;case 603979792:this.g.appendNew=c;break;case 603979800:this.g.autoFps=c;break;case 603979971:JU.DF.setUseNumberLocalization(this.g.useNumberLocalization=c);break;case 603979918:case 1611272202:a="showFrank";this.setFrankOn(c);break;case 1612709912:a="solventProbe";this.g.dotSolvent=c;break;case 603979948:this.g.dotSolvent=
c;break;case 603979785:this.g.allowRotateSelected=c;break;case 603979783:this.g.allowMoveAtoms=c;this.showSelected=!1;break;case 536870922:this.setIntPropertyTok("showScript",b,c?1:0);return;case 603979778:this.g.allowEmbeddedScripts=c;break;case 603979890:this.g.navigationPeriodic=c;break;case 603979984:this.tm.setZShadeEnabled(c);return;case 603979832:this.haveDisplay&&(this.g.drawHover=c);break;case 603979889:this.setNavigationMode(c);break;case 603979888:return;case 603979860:this.g.hideNavigationPoint=
c;break;case 603979930:this.g.showNavigationPointAlways=c;break;case 603979900:this.setRefreshing(c);break;case 603979869:this.g.jmolInJSpecView=c;break;case 603979870:this.g.justifyMeasurements=c;break;case 603979952:this.g.ssbondsBackbone=c;break;case 603979852:this.g.hbondsBackbone=c;break;case 603979854:this.g.hbondsSolid=c;break;case 536870924:this.gdata.setSpecular(c);break;case 603979942:this.tm.setSlabEnabled(c);return;case 603979980:this.tm.setZoomEnabled(c);return;case 603979864:this.g.highResolutionFlag=
c;break;case 603979966:this.g.traceAlpha=c;break;case 603979983:this.g.zoomLarge=c;this.tm.setZoomHeight(this.g.zoomHeight,c);break;case 603979982:this.g.zoomHeight=c;this.tm.setZoomHeight(c,this.g.zoomLarge);break;case 603979871:J.i18n.GT.setDoTranslate(c);break;case 603979862:this.slm.setHideNotSelected(c);break;case 603979904:this.setScriptQueue(c);break;case 603979830:this.g.dotSurface=c;break;case 603979829:this.g.dotsSelectedOnly=c;break;case 1611141171:this.setSelectionHalosEnabled(c);break;
case 603979910:this.g.rasmolHydrogenSetting=c;break;case 603979908:this.g.rasmolHeteroSetting=c;break;case 603979928:this.g.showMultipleBonds=c;break;case 603979920:this.g.showHiddenSelectionHalos=c;break;case 603979976:this.tm.setWindowCentered(c);break;case 603979828:this.g.displayCellParameters=c;break;case 603979960:this.g.testFlag1=c;break;case 603979962:this.g.testFlag2=c;break;case 603979964:this.g.testFlag3=c;break;case 603979965:this.jmolTest();this.g.testFlag4=c;break;case 603979901:this.g.ribbonBorder=
c;break;case 603979815:this.g.cartoonBaseEdges=c;break;case 603979819:this.g.cartoonRockets=c;break;case 603979902:this.g.rocketBarrels=c;break;case 603979850:this.gdata.setGreyscaleMode(this.g.greyscaleRendering=c);break;case 603979878:this.g.measurementLabels=c;break;case 603979809:case 603979804:case 603979808:this.setAxesMode(b);return;case 603979806:this.setAxesOrientationRasmol(c);return;case 603979824:this.setStringPropertyTok("defaultcolorscheme",545259545,c?"rasmol":"jmol");return;case 603979825:this.setDebugScript(c);
return;case 603979897:this.setPerspectiveDepth(c);return;case 603979798:this.setAutoBond(c);return;case 603979914:this.setShowAxes(c);return;case 603979916:this.setShowBbcage(c);return;case 603979922:this.setShowHydrogens(c);return;case 603979926:this.setShowMeasurements(c);return;case 603979936:this.setShowUnitCell(c);return;case 603979812:g=!1;this.g.bondModeOr=c;break;case 603979978:g=!1;this.g.zeroBasedXyzRasmol=c;this.reset(!0);break;case 603979899:g=!1;this.g.rangeSelected=c;break;case 603979877:g=
!1;this.g.measureAllModels=c;break;case 603979954:g=!1;this.sm.allowStatusReporting=c;break;case 603979822:g=!1;this.g.chainCaseSensitive=c;break;case 603979858:g=!1;this.g.hideNameInPopup=c;break;case 603979827:g=!1;this.g.disablePopupMenu=c;break;case 603979846:g=!1;this.g.forceAutoBond=c;break;default:if(!this.g.htBooleanParameterFlags.containsKey(a.toLowerCase())){this.g.setUserVariable(a,JS.SV.getBoolean(c));return}}this.g.setB(a,c);g&&this.setTainted(!0)},"~S,~N,~B");c(c$,"setModelKitMode",
function(a){if(null!=this.acm&&this.allowScripting){if(a||this.g.modelKitMode)this.setPickingMode(null,a?33:1),this.setPickingMode(null,a?32:1);var b=this.g.modelKitMode!=a;this.g.modelKitMode=a;this.g.setB("modelkitmode",a);this.highlight(null);a?(this.setNavigationMode(!1),this.selectAll(),this.setStringProperty("picking","assignAtom_C"),this.setStringProperty("picking","assignBond_p"),this.isApplet||this.popupMenu(10,0,"m"),b&&this.sm.setStatusModelKit(1),this.g.modelKitMode=!0,0==this.ms.ac?this.zap(!1,
!0,!0):0<=this.am.cmi&&this.getModelUndeletedAtomsBitSet(this.am.cmi).isEmpty()&&(a=new java.util.Hashtable,a.put("appendToModelIndex",Integer.$valueOf(this.am.cmi)),this.loadDefaultModelKitModel(a))):(this.acm.setPickingMode(-1),this.setStringProperty("pickingStyle","toggle"),this.setBooleanProperty("bondPicking",!1),b&&this.sm.setStatusModelKit(0))}},"~B");c(c$,"setSmilesString",function(a){null==a?this.g.removeParam("_smilesString"):this.g.setO("_smilesString",a)},"~S");c(c$,"removeUserVariable",
function(a){this.g.removeUserVariable(a);a.endsWith("callback")&&this.sm.setCallbackFunction(a,null)},"~S");c(c$,"jmolTest",function(){});c(c$,"showParameter",function(a,b,c){c=""+this.g.getParameterEscaped(a,c);(b||0>c.indexOf("<not defined>"))&&this.showString(a+" = "+c,!1)},"~S,~B,~N");c(c$,"showString",function(a,b){!JV.Viewer.isJS&&(this.isScriptQueued()&&(!this.isSilent||b)&&!"\x00".equals(a))&&JU.Logger.warn(a);this.scriptEcho(a)},"~S,~B");c(c$,"getAllSettings",function(a){return this.getStateCreator().getAllSettings(a)},
"~S");c(c$,"getBindingInfo",function(a){return this.haveDisplay?this.acm.getBindingInfo(a):""},"~S");c(c$,"getIsosurfacePropertySmoothing",function(a){return a?this.g.isosurfacePropertySmoothingPower:this.g.isosurfacePropertySmoothing?1:0},"~B");c(c$,"setNavigationDepthPercent",function(a){this.tm.setNavigationDepthPercent(a);this.refresh(1,"set navigationDepth")},"~N");c(c$,"getShowNavigationPoint",function(){return!this.g.navigationMode?!1:this.tm.isNavigating()&&!this.g.hideNavigationPoint||this.g.showNavigationPointAlways||
this.getInMotion(!0)});j(c$,"setPerspectiveDepth",function(a){this.tm.setPerspectiveDepth(a)},"~B");j(c$,"setAxesOrientationRasmol",function(a){this.g.setB("axesOrientationRasmol",a);this.g.axesOrientationRasmol=a;this.reset(!0)},"~B");c(c$,"setAxesScale",function(a,b){b=JV.Viewer.checkFloatRange(b,-100,100);570425345==a?this.g.axesOffset=b:this.g.axesScale=b;this.axesAreTainted=!0},"~N,~N");c(c$,"setAxesMode",function(a){this.g.axesMode=a;this.axesAreTainted=!0;switch(a){case 603979808:this.g.removeParam("axesmolecular");
this.g.removeParam("axeswindow");this.g.setB("axesUnitcell",!0);a=2;break;case 603979804:this.g.removeParam("axesunitcell");this.g.removeParam("axeswindow");this.g.setB("axesMolecular",!0);a=1;break;case 603979809:this.g.removeParam("axesunitcell"),this.g.removeParam("axesmolecular"),this.g.setB("axesWindow",!0),a=0}this.g.setI("axesMode",a)},"~N");c(c$,"getSelectionHalosEnabled",function(){return this.selectionHalosEnabled});c(c$,"setSelectionHalosEnabled",function(a){this.selectionHalosEnabled!=
a&&(this.g.setB("selectionHalos",a),this.shm.loadShape(8),this.selectionHalosEnabled=a)},"~B");c(c$,"getShowSelectedOnce",function(){var a=this.showSelected;this.showSelected=!1;return a});c(c$,"setStrandCount",function(a,b){b=JV.Viewer.checkIntRange(b,0,20);switch(a){case 12:this.g.strandCountForStrands=b;break;case 13:this.g.strandCountForMeshRibbon=b;break;default:this.g.strandCountForStrands=b,this.g.strandCountForMeshRibbon=b}this.g.setI("strandCount",b);this.g.setI("strandCountForStrands",this.g.strandCountForStrands);
this.g.setI("strandCountForMeshRibbon",this.g.strandCountForMeshRibbon)},"~N,~N");c(c$,"getStrandCount",function(a){return 12==a?this.g.strandCountForStrands:this.g.strandCountForMeshRibbon},"~N");c(c$,"setNavigationMode",function(a){this.g.navigationMode=a;this.tm.setNavigationMode(a)},"~B");j(c$,"setAutoBond",function(a){this.g.setB("autobond",a);this.g.autoBond=a},"~B");c(c$,"makeConnections",function(a,b,c,g,f,e,h,j,l,n){this.clearModelDependentObjects();this.clearMinimization();return this.ms.makeConnections(a,
b,c,g,f,e,h,j,l,n)},"~N,~N,~N,~N,JU.BS,JU.BS,JU.BS,~B,~B,~N");j(c$,"rebond",function(){this.rebondState(!1)});c(c$,"rebondState",function(a){this.clearModelDependentObjects();this.ms.deleteAllBonds();a=a&&this.g.legacyAutoBonding;this.ms.autoBondBs4(null,null,null,null,this.getMadBond(),a);this.addStateScript(a?"set legacyAutoBonding TRUE;connect;set legacyAutoBonding FALSE;":"connect;",!1,!0)},"~B");j(c$,"setPercentVdwAtom",function(a){this.g.setI("percentVdwAtom",a);this.g.percentVdwAtom=a;this.rd.value=
a/100;this.rd.factorType=J.atomdata.RadiusData.EnumType.FACTOR;this.rd.vdwType=J.c.VDW.AUTO;this.shm.setShapeSizeBs(0,0,this.rd,null)},"~N");j(c$,"getMadBond",function(){return 2*this.g.bondRadiusMilliAngstroms});j(c$,"setShowHydrogens",function(a){this.g.setB("showHydrogens",a);this.g.showHydrogens=a},"~B");c(c$,"setShowBbcage",function(a){this.setObjectMad10(32,"boundbox",a?-4:0);this.g.setB("showBoundBox",a)},"~B");c(c$,"getShowBbcage",function(){return 0!=this.getObjectMad10(4)});c(c$,"setShowUnitCell",
function(a){this.setObjectMad10(33,"unitcell",a?-2:0);this.g.setB("showUnitCell",a)},"~B");c(c$,"getShowUnitCell",function(){return 0!=this.getObjectMad10(5)});c(c$,"setShowAxes",function(a){this.setObjectMad10(34,"axes",a?-2:0);this.g.setB("showAxes",a)},"~B");c(c$,"getShowAxes",function(){return 0!=this.getObjectMad10(1)});j(c$,"setFrankOn",function(a){this.isPreviewOnly&&(a=!1);this.frankOn=a;this.setObjectMad10(36,"frank",a?1:0)},"~B");c(c$,"getShowFrank",function(){return this.isPreviewOnly||
this.isApplet&&this.creatingImage?!1:this.isSignedApplet&&!this.isSignedAppletLocal&&!JV.Viewer.isJS||this.frankOn});j(c$,"setShowMeasurements",function(a){this.g.setB("showMeasurements",a);this.g.showMeasurements=a},"~B");c(c$,"setUnits",function(a,b){this.g.setUnits(a);b&&(this.g.setUnits(a),this.setShapeProperty(6,"reformatDistances",null))},"~S,~B");j(c$,"setRasmolDefaults",function(){this.setDefaultsType("RasMol")});j(c$,"setJmolDefaults",function(){this.setDefaultsType("Jmol")});c(c$,"setDefaultsType",
function(a){a.equalsIgnoreCase("RasMol")?this.stm.setRasMolDefaults():a.equalsIgnoreCase("PyMOL")?this.stm.setPyMOLDefaults():(this.stm.setJmolDefaults(),this.setIntProperty("bondingVersion",0),this.shm.setShapeSizeBs(0,0,this.rd,this.getAllAtoms()))},"~S");c(c$,"setAntialias",function(a,b){var c=!1;switch(a){case 603979786:c=this.g.antialiasDisplay!=b;this.g.antialiasDisplay=b;break;case 603979790:c=this.g.antialiasTranslucent!=b;this.g.antialiasTranslucent=b;break;case 603979788:this.g.antialiasImages=
b;return}c&&(this.resizeImage(0,0,!1,!1,!0),this.refresh(3,"Viewer:setAntialias()"))},"~N,~B");c(c$,"allocTempPoints",function(a){return this.tempArray.allocTempPoints(a)},"~N");c(c$,"freeTempPoints",function(a){this.tempArray.freeTempPoints(a)},"~A");c(c$,"allocTempScreens",function(a){return this.tempArray.allocTempScreens(a)},"~N");c(c$,"freeTempScreens",function(a){this.tempArray.freeTempScreens(a)},"~A");c(c$,"allocTempEnum",function(a){return this.tempArray.allocTempEnum(a)},"~N");c(c$,"freeTempEnum",
function(a){this.tempArray.freeTempEnum(a)},"~A");c(c$,"getFont3D",function(a,b,c){return this.gdata.getFont3DFSS(a,b,c)},"~S,~S,~N");c(c$,"getAtomGroupQuaternions",function(a,b){return this.ms.getAtomGroupQuaternions(a,b,this.getQuaternionFrame())},"JU.BS,~N");c(c$,"setStereoMode",function(a,b,c){this.setFloatProperty("stereoDegrees",c);this.setBooleanProperty("greyscaleRendering",b.isBiColor());null!=a?this.tm.setStereoMode2(a):this.tm.setStereoMode(b)},"~A,J.c.STER,~N");c(c$,"getChimeInfo",function(a){return this.getPropertyManager().getChimeInfo(a,
this.bsA())},"~N");c(c$,"getModelFileInfo",function(){return this.getPropertyManager().getModelFileInfo(this.getVisibleFramesBitSet())});c(c$,"getModelFileInfoAll",function(){return this.getPropertyManager().getModelFileInfo(null)});c(c$,"showEditor",function(a){var b=this.getProperty("DATA_API","getScriptEditor",Boolean.TRUE);null!=b&&b.show(a)},"~A");c(c$,"getPropertyManager",function(){null==this.pm&&(this.pm=J.api.Interface.getInterface("JV.PropertyManager",this,"prop")).setViewer(this);return this.pm});
c(c$,"setTainted",function(a){this.isTainted=this.axesAreTainted=a&&(this.refreshing||this.creatingImage)},"~B");c(c$,"checkObjectClicked",function(a,b,c){return this.shm.checkObjectClicked(a,b,c,this.getVisibleFramesBitSet(),this.g.drawPicking)},"~N,~N,~N");c(c$,"checkObjectHovered",function(a,b){return 0<=a&&null!=this.shm&&this.shm.checkObjectHovered(a,b,this.getVisibleFramesBitSet(),this.getBondsPickable())},"~N,~N");c(c$,"checkObjectDragged",function(a,b,c,g,f){var e=0;switch(this.getPickingMode()){case 2:e=
5;break;case 4:e=22}return this.shm.checkObjectDragged(a,b,c,g,f,this.getVisibleFramesBitSet(),e)?(this.refresh(1,"checkObjectDragged"),22==e&&this.scriptEcho(this.getShapeProperty(22,"command")),!0):!1},"~N,~N,~N,~N,~N");c(c$,"rotateAxisAngleAtCenter",function(a,b,c,g,f,e,h){(a=this.tm.rotateAxisAngleAtCenter(a,b,c,g,f,e,h))&&this.setSync();return a},"J.api.JmolScriptEvaluator,JU.P3,JU.V3,~N,~N,~B,JU.BS");c(c$,"rotateAboutPointsInternal",function(a,b,c,g,f,e,h,j,l,n,m){null==a&&(a=this.eval);if(this.headless){if(e&&
3.4028235E38==f)return!1;e=!1}(a=this.tm.rotateAboutPointsInternal(a,b,c,g,f,!1,e,h,!1,j,l,n,m))&&this.setSync();return a},"J.api.JmolScriptEvaluator,JU.P3,JU.P3,~N,~N,~B,JU.BS,JU.V3,JU.Lst,~A,JU.M4");c(c$,"startSpinningAxis",function(a,b,c){this.tm.spinOn||this.tm.navOn?(this.tm.setSpinOff(),this.tm.setNavOn(!1)):this.tm.rotateAboutPointsInternal(null,a,b,this.g.pickingSpinRate,3.4028235E38,c,!0,null,!1,null,null,null,null)},"JU.T3,JU.T3,~B");c(c$,"getModelDipole",function(){return this.ms.getModelDipole(this.am.cmi)});
c(c$,"calculateMolecularDipole",function(a){try{return this.ms.calculateMolecularDipole(this.am.cmi,a)}catch(b){if(H(b,JV.JmolAsyncException))return null!=this.eval&&this.eval.loadFileResourceAsync(b.getFileName()),null;throw b;}},"JU.BS");c(c$,"setDefaultLattice",function(a){Float.isNaN(a.x+a.y+a.z)||this.g.ptDefaultLattice.setT(a);this.g.setO("defaultLattice",JU.Escape.eP(a))},"JU.P3");c(c$,"getDefaultLattice",function(){return this.g.ptDefaultLattice});c(c$,"getModelExtract",function(a,b,c,g){return this.getPropertyManager().getModelExtract(this.getAtomBitSet(a),
b,c,g,!1)},"~O,~B,~B,~S");j(c$,"getData",function(a,b){return this.getModelFileData(a,b,!0)},"~S,~S");c(c$,"getModelFileData",function(a,b,c){return this.getPropertyManager().getAtomData(a,b,c)},"~S,~S,~B");c(c$,"getModelCml",function(a,b,c,g){return this.getPropertyManager().getModelCml(a,b,c,g,!1)},"JU.BS,~N,~B,~B");c(c$,"getPdbAtomData",function(a,b,c,g){return this.getPropertyManager().getPdbAtomData(null==a?this.bsA():a,b,c,g,!1)},"JU.BS,JU.OC,~B,~B");c(c$,"isJmolDataFrame",function(){return this.ms.isJmolDataFrameForModel(this.am.cmi)});
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this.setModelkitProperty("screenXY",B(-1,[c,g]));a=this.setModelkitProperty("hoverLabel",Integer.$valueOf(-2-a));null!=a&&this.hoverOnPt(c,g,a,null,null);this.refresh(3,"highlightBond")}},"~N,~N,~N,~N");c(c$,"highlight",function(a){this.atomHighlighted=null!=a&&1==a.cardinality()?a.nextSetBit(0):-1;null==a?this.setCursor(0):(this.shm.loadShape(8),this.setCursor(12));this.setModelkitProperty("highlight",a);this.setShapeProperty(8,"highlight",a)},"JU.BS");c(c$,"refreshMeasures",function(a){this.setShapeProperty(6,
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