Uses of Class
biotransformer.utils.ChemicalClassFinder.ChemicalClassName
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Packages that use ChemicalClassFinder.ChemicalClassName Package Description biotransformer.esaprediction biotransformer.utils -
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Uses of ChemicalClassFinder.ChemicalClassName in biotransformer.esaprediction
Method parameters in biotransformer.esaprediction with type arguments of type ChemicalClassFinder.ChemicalClassName Modifier and Type Method Description boolean
ESSpecificityPredictor. isValidCyp450Substrate(org.openscience.cdk.interfaces.IAtomContainer substrate, Enzyme.EnzymeName enz, java.util.ArrayList<ChemicalClassFinder.ChemicalClassName> chemClasses)
boolean
ESSpecificityPredictor. isValidSubstrate(org.openscience.cdk.interfaces.IAtomContainer substrate, Enzyme.EnzymeName enz, java.util.ArrayList<ChemicalClassFinder.ChemicalClassName> chemClasses)
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Uses of ChemicalClassFinder.ChemicalClassName in biotransformer.utils
Fields in biotransformer.utils with type parameters of type ChemicalClassFinder.ChemicalClassName Modifier and Type Field Description static java.util.LinkedHashMap<ChemicalClassFinder.ChemicalClassName,java.util.LinkedHashMap<java.lang.String,java.lang.String[]>>
ChemicalClassFinder. chemicalClassDefinitions
Methods in biotransformer.utils that return ChemicalClassFinder.ChemicalClassName Modifier and Type Method Description static ChemicalClassFinder.ChemicalClassName
ChemicalClassFinder. findChemicalClass(org.openscience.cdk.interfaces.IAtomContainer molecule)
static ChemicalClassFinder.ChemicalClassName
ChemicalClassFinder.ChemicalClassName. valueOf(java.lang.String name)
Returns the enum constant of this type with the specified name.static ChemicalClassFinder.ChemicalClassName[]
ChemicalClassFinder.ChemicalClassName. values()
Returns an array containing the constants of this enum type, in the order they are declared.Methods in biotransformer.utils that return types with arguments of type ChemicalClassFinder.ChemicalClassName Modifier and Type Method Description static java.util.ArrayList<ChemicalClassFinder.ChemicalClassName>
ChemicalClassFinder. AssignChemicalClasses(org.openscience.cdk.interfaces.IAtomContainer molecule)
Methods in biotransformer.utils with parameters of type ChemicalClassFinder.ChemicalClassName Modifier and Type Method Description static boolean
ChemicalClassFinder. compoundMatchesClassSmartsDefinitions(org.openscience.cdk.interfaces.IAtomContainer molecule, ChemicalClassFinder.ChemicalClassName className)
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