nvmolkit-0.5.0.dist-info/INSTALLER,sha256=zuuue4knoyJ-UwPPXg8fezS7VCrXJQrAP7zeNuwvFQg,4
nvmolkit-0.5.0.dist-info/METADATA,sha256=IwpOlQZFoBcdavdnsAgL2gTB1PE8lbCYr1jJLsNDM18,863
nvmolkit-0.5.0.dist-info/RECORD,,
nvmolkit-0.5.0.dist-info/REQUESTED,sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU,0
nvmolkit-0.5.0.dist-info/WHEEL,sha256=efGswgF4Hjujk_OVzgTdEYIQTW4-qvVS-nObrlz3rP0,99
nvmolkit-0.5.0.dist-info/direct_url.json,sha256=Cr4jNzEk99_D37xNP834KG_tZBBcHdtRnbPPRIm5eT0,119
nvmolkit-0.5.0.dist-info/top_level.txt,sha256=t4hpHBMnuGy1vz-jslAxQmd5zQ_grtVXbQ-xjCJhyA0,9
nvmolkit/_DataStructs.so,sha256=v4Jo-zh4E23qgu1TAn2loOvCCj9p0n6q29xn5yBQS9o,1448112
nvmolkit/_Fingerprints.so,sha256=EyqMiSmaz3f89a2luvZ1AbOEMrFMRDOz9mqlbdPRyZY,6233984
nvmolkit/_TFD.so,sha256=xdiZKFM5YjHrGtzEP8yzQ-nfrmvkHBP0IY9vThbx1-k,516152
nvmolkit/__init__.py,sha256=h18EYCS4uUudFfEKUKeglRYG6hKQD_uuW2Czzvb7hVA,1576
nvmolkit/__pycache__/__init__.cpython-311.pyc,,
nvmolkit/__pycache__/_fusedButina.cpython-311.pyc,,
nvmolkit/__pycache__/_mmff_bridge.cpython-311.pyc,,
nvmolkit/__pycache__/batchedForcefield.cpython-311.pyc,,
nvmolkit/__pycache__/clustering.cpython-311.pyc,,
nvmolkit/__pycache__/conformerRmsd.cpython-311.pyc,,
nvmolkit/__pycache__/embedMolecules.cpython-311.pyc,,
nvmolkit/__pycache__/fingerprints.cpython-311.pyc,,
nvmolkit/__pycache__/mmffOptimization.cpython-311.pyc,,
nvmolkit/__pycache__/similarity.cpython-311.pyc,,
nvmolkit/__pycache__/substructure.cpython-311.pyc,,
nvmolkit/__pycache__/tfd.cpython-311.pyc,,
nvmolkit/__pycache__/types.cpython-311.pyc,,
nvmolkit/__pycache__/uffOptimization.cpython-311.pyc,,
nvmolkit/_arrayHelpers.so,sha256=qReUmbD--a6rQgxE56stR1wCrSWWAdPRATzZ8UoynXs,51328
nvmolkit/_batchedForcefield.so,sha256=raLQtsHiX7-bzlcs1fREe-m7PiMsoh57QVR9r5QD8JM,63294960
nvmolkit/_clustering.so,sha256=vnRaFJ6KX4t3AcVaUFuI9WP2897llFV_gUMQS9Fd-Nk,4337368
nvmolkit/_conformerRmsd.so,sha256=d0EePaCoirpB9vFg8e7ygnvdeejMHi9PvFyAPvrUAYU,1260632
nvmolkit/_embedMolecules.so,sha256=cvFrb18Y8anxAMAujb92sSbuoMOG3QPz2i69ydcdTdE,65258344
nvmolkit/_fusedButina.py,sha256=zm5p3caOTTfKkbHkFY8p0dPpcTPCsDynabvG9xyLBL8,11365
nvmolkit/_mmffOptimization.so,sha256=4oj7R50jcVzxWgE0_gnwS3UfdOtDCc-_4lnrqN9jkrg,58094248
nvmolkit/_mmff_bridge.py,sha256=iFJasG40juxpq0iVvfFfCSBbZbvLWu9H2CGy_ZR6UB4,2536
nvmolkit/_substructure.so,sha256=3suDVTvlPZrFzogLSLHSDucsW4vjQaeRDV3LJ66UtjM,22028816
nvmolkit/_uffOptimization.so,sha256=U7QlhEW9AH9D7z9wrC-R4kBN0ZsLYFzW6XWMuTaoPiQ,62905368
nvmolkit/autotune/__init__.py,sha256=DfjnB5_JyQkpjy7swho0p2Y6hm0LoLh4SJ3gT4V_f0I,2595
nvmolkit/autotune/__pycache__/__init__.cpython-311.pyc,,
nvmolkit/autotune/__pycache__/_calibration.cpython-311.pyc,,
nvmolkit/autotune/__pycache__/_core.cpython-311.pyc,,
nvmolkit/autotune/__pycache__/_ff_common.cpython-311.pyc,,
nvmolkit/autotune/__pycache__/_persistence.cpython-311.pyc,,
nvmolkit/autotune/__pycache__/tune_batched_forcefield.cpython-311.pyc,,
nvmolkit/autotune/__pycache__/tune_embed_molecules.cpython-311.pyc,,
nvmolkit/autotune/__pycache__/tune_mmff_optimize.cpython-311.pyc,,
nvmolkit/autotune/__pycache__/tune_substructure.cpython-311.pyc,,
nvmolkit/autotune/__pycache__/tune_uff_optimize.cpython-311.pyc,,
nvmolkit/autotune/_calibration.py,sha256=FBbxz3Bdw8p6KWQ9vikq65AcfVg0jMK59W9W9G7jcmg,3380
nvmolkit/autotune/_core.py,sha256=UKOCqCB47yb9C8AQFabZ5exeQbxBXGLtGoDEX-m03Wc,13813
nvmolkit/autotune/_ff_common.py,sha256=-v0kgljkQ4IJRvsaIFhtMpFo62KP8-B50ZnM9isMobg,3548
nvmolkit/autotune/_persistence.py,sha256=TrC775Uo_hRyqkJ52lCictYW1o_kWwd356QyACGHZQk,2522
nvmolkit/autotune/tune_batched_forcefield.py,sha256=Kjw9--JuWOxDOsXHobcmSOcJ-zxuBCEIIbbH2sHKQRQ,6912
nvmolkit/autotune/tune_embed_molecules.py,sha256=8-oteEPWcLvaQ2Mxry-TB1CIZV0_mJ-ADOjNrOggVAk,7501
nvmolkit/autotune/tune_mmff_optimize.py,sha256=39zFA1f65dca6Jl0X5I5IMfiNHZjIh3J-agOv9Ip1EE,7244
nvmolkit/autotune/tune_substructure.py,sha256=TkGKp891516HUPBpgQr_yKfkK-zv7uc6m9t5vNOE9XI,9721
nvmolkit/autotune/tune_uff_optimize.py,sha256=tyvAzuh9NFt9DxNaz11thV3rxSJ06C1XdyBpAguJzC4,6464
nvmolkit/batchedForcefield.py,sha256=7Zvpys69Q9yz1J-qxP3iWJkFueti3PTmRjJPjAuZ-co,26773
nvmolkit/clustering.py,sha256=ZrKVKQ2Wg1v-VVFIB8t3jkuxqWVq5-bH8SFDCWsUq50,8789
nvmolkit/conformerRmsd.py,sha256=8f-PUQbWED5n7KLAonoSN4ZB_IYn5DQ4MtoGyyKM54o,6858
nvmolkit/embedMolecules.py,sha256=Rwx6_9LiPqKqyCsJ61RiDyOrEUJtAe-8VuTiaN5-SoQ,6847
nvmolkit/fingerprints.py,sha256=vxxwf08uuSkXLMTs1P0HskHP4Ho7GtuySla4U69cL-o,4607
nvmolkit/mmffOptimization.py,sha256=1PCggRfC1jqraWo8lI9QXj-RwGUPFOsDd44VzkviXcU,9445
nvmolkit/similarity.py,sha256=NV4S7dm1Zc4j0KPGQM_5BK9033FXGKzqeiXvzGn9kX0,8523
nvmolkit/substructure.py,sha256=-bXTuka1I2D408hdB7D6abnLWaA5MTwBX-9Pow_H7r4,11342
nvmolkit/tfd.py,sha256=agvYJSoiE5P_JI5NXeoIMIbJaBrk9pnv2NPCx06EfHo,7134
nvmolkit/types.py,sha256=HjgIuFycfy-pIEZAmMBbQS_HVmbUTCKBmITnbH2_J58,13646
nvmolkit/uffOptimization.py,sha256=Beywt9cFqFvibmH3gIsAl2YonnI8UBiR9u9yxMkhw0Q,5798
