Chemical Data Processing Library Python API - Version 1.2.0
CDPL.Descr.BCUTDescriptorCalculator Member List

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.BCUTDescriptorCalculatorstatic
setAtomWeightFunction(ForceField.MMFF94AtomChargeFunction func)CDPL.Descr.BCUTDescriptorCalculator
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