Chemical Data Processing Library C++ API - Version 1.1.1
CDPL::ForceField::MMFF94PartialBondChargeIncrementTable::Entry Member List

This is the complete list of members for CDPL::ForceField::MMFF94PartialBondChargeIncrementTable::Entry, including all inherited members.

Entry()CDPL::ForceField::MMFF94PartialBondChargeIncrementTable::Entry
Entry(unsigned int atom_type, double part_bond_chg_inc, double form_chg_adj_factor)CDPL::ForceField::MMFF94PartialBondChargeIncrementTable::Entry
getAtomType() constCDPL::ForceField::MMFF94PartialBondChargeIncrementTable::Entry
getFormalChargeAdjustmentFactor() constCDPL::ForceField::MMFF94PartialBondChargeIncrementTable::Entry
getPartialChargeIncrement() constCDPL::ForceField::MMFF94PartialBondChargeIncrementTable::Entry
operator bool() constCDPL::ForceField::MMFF94PartialBondChargeIncrementTable::Entry