Chemical Data Processing Library Python API - Version 1.2.0
CDPL.MolProp.PEOESigmaChargeCalculator Member List

This is the complete list of members for CDPL.MolProp.PEOESigmaChargeCalculator, including all inherited members.

__init__()CDPL.MolProp.PEOESigmaChargeCalculator
__init__(Chem.MolecularGraph molgraph)CDPL.MolProp.PEOESigmaChargeCalculator
calculate(Chem.MolecularGraph molgraph)CDPL.MolProp.PEOESigmaChargeCalculator
dampingFactor (defined in CDPL.MolProp.PEOESigmaChargeCalculator)CDPL.MolProp.PEOESigmaChargeCalculatorstatic
DEF_DAMPING_FACTOR (defined in CDPL.MolProp.PEOESigmaChargeCalculator)CDPL.MolProp.PEOESigmaChargeCalculatorstatic
DEF_NUM_ITERATIONS (defined in CDPL.MolProp.PEOESigmaChargeCalculator)CDPL.MolProp.PEOESigmaChargeCalculatorstatic
getCharge(int idx)CDPL.MolProp.PEOESigmaChargeCalculator
getDampingFactor()CDPL.MolProp.PEOESigmaChargeCalculator
getElectronegativity(int idx)CDPL.MolProp.PEOESigmaChargeCalculator
getNumIterations()CDPL.MolProp.PEOESigmaChargeCalculator
getObjectID()CDPL.MolProp.PEOESigmaChargeCalculator
numIterations (defined in CDPL.MolProp.PEOESigmaChargeCalculator)CDPL.MolProp.PEOESigmaChargeCalculatorstatic
objectID (defined in CDPL.MolProp.PEOESigmaChargeCalculator)CDPL.MolProp.PEOESigmaChargeCalculatorstatic
setDampingFactor(float factor)CDPL.MolProp.PEOESigmaChargeCalculator
setNumIterations(int num_iter)CDPL.MolProp.PEOESigmaChargeCalculator