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Chemical Data Processing Library Python API - Version 1.1.1
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Chemical Data Processing Library Python API - Version 1.1.1
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This is the complete list of members for CDPL.Descr.BCUTDescriptorCalculator, including all inherited members.
| __init__() | CDPL.Descr.BCUTDescriptorCalculator | |
| __init__(Chem.MolecularGraph molgraph, Math.DVector descr) | CDPL.Descr.BCUTDescriptorCalculator | |
| calculate(Chem.MolecularGraph molgraph, Math.DVector descr) | CDPL.Descr.BCUTDescriptorCalculator | |
| getObjectID() | CDPL.Descr.BCUTDescriptorCalculator | |
| objectID (defined in CDPL.Descr.BCUTDescriptorCalculator) | CDPL.Descr.BCUTDescriptorCalculator | static |
| setAtomWeightFunction(ForceField.MMFF94AtomChargeFunction func) | CDPL.Descr.BCUTDescriptorCalculator |
1.8.20