Chemical Data Processing Library C++ API - Version 1.1.1
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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() const | CDPL::ForceField::MMFF94PartialBondChargeIncrementTable::Entry | |
getFormalChargeAdjustmentFactor() const | CDPL::ForceField::MMFF94PartialBondChargeIncrementTable::Entry | |
getPartialChargeIncrement() const | CDPL::ForceField::MMFF94PartialBondChargeIncrementTable::Entry | |
operator bool() const | CDPL::ForceField::MMFF94PartialBondChargeIncrementTable::Entry |