Chemical Data Processing Library C++ API - Version 1.2.0
CDPL::ForceField::MMFF94AngleBendingInteractionParameterizer Member List

This is the complete list of members for CDPL::ForceField::MMFF94AngleBendingInteractionParameterizer, including all inherited members.

MMFF94AngleBendingInteractionParameterizer()CDPL::ForceField::MMFF94AngleBendingInteractionParameterizer
MMFF94AngleBendingInteractionParameterizer(const Chem::MolecularGraph &molgraph, MMFF94AngleBendingInteractionList &ia_list, bool strict)CDPL::ForceField::MMFF94AngleBendingInteractionParameterizer
parameterize(const Chem::MolecularGraph &molgraph, MMFF94AngleBendingInteractionList &ia_list, bool strict)CDPL::ForceField::MMFF94AngleBendingInteractionParameterizer
setAngleBendingParameterTable(const MMFF94AngleBendingParameterTable::SharedPointer &table)CDPL::ForceField::MMFF94AngleBendingInteractionParameterizer
setAromaticRingSetFunction(const MMFF94RingSetFunction &func)CDPL::ForceField::MMFF94AngleBendingInteractionParameterizer
setAtomTypeFunction(const MMFF94NumericAtomTypeFunction &func)CDPL::ForceField::MMFF94AngleBendingInteractionParameterizer
setAtomTypePropertyTable(const MMFF94AtomTypePropertyTable::SharedPointer &table)CDPL::ForceField::MMFF94AngleBendingInteractionParameterizer
setBondStretchingParameterTable(const MMFF94BondStretchingParameterTable::SharedPointer &table)CDPL::ForceField::MMFF94AngleBendingInteractionParameterizer
setBondStretchingRuleParameterTable(const MMFF94BondStretchingRuleParameterTable::SharedPointer &table)CDPL::ForceField::MMFF94AngleBendingInteractionParameterizer
setBondTypeIndexFunction(const MMFF94BondTypeIndexFunction &func)CDPL::ForceField::MMFF94AngleBendingInteractionParameterizer
setFilterFunction(const InteractionFilterFunction3 &func)CDPL::ForceField::MMFF94AngleBendingInteractionParameterizer
setParameterAtomTypeMap(const MMFF94PrimaryToParameterAtomTypeMap::SharedPointer &map)CDPL::ForceField::MMFF94AngleBendingInteractionParameterizer
SharedPointer typedefCDPL::ForceField::MMFF94AngleBendingInteractionParameterizer