CDPL::ForceField::MMFF94VanDerWaalsInteractionParameterizer Member List

This is the complete list of members for CDPL::ForceField::MMFF94VanDerWaalsInteractionParameterizer, including all inherited members.

MMFF94VanDerWaalsInteractionParameterizer()	CDPL::ForceField::MMFF94VanDerWaalsInteractionParameterizer
MMFF94VanDerWaalsInteractionParameterizer(const Chem::MolecularGraph &molgraph, MMFF94VanDerWaalsInteractionList &ia_list, bool strict)	CDPL::ForceField::MMFF94VanDerWaalsInteractionParameterizer
parameterize(const Chem::MolecularGraph &molgraph, MMFF94VanDerWaalsInteractionList &ia_list, bool strict)	CDPL::ForceField::MMFF94VanDerWaalsInteractionParameterizer
setAtomTypeFunction(const MMFF94NumericAtomTypeFunction &func)	CDPL::ForceField::MMFF94VanDerWaalsInteractionParameterizer
setFilterFunction(const InteractionFilterFunction2 &func)	CDPL::ForceField::MMFF94VanDerWaalsInteractionParameterizer
setTopologicalDistanceFunction(const TopologicalAtomDistanceFunction &func)	CDPL::ForceField::MMFF94VanDerWaalsInteractionParameterizer
setVanDerWaalsParameterTable(const MMFF94VanDerWaalsParameterTable::SharedPointer &table)	CDPL::ForceField::MMFF94VanDerWaalsInteractionParameterizer
SharedPointer typedef	CDPL::ForceField::MMFF94VanDerWaalsInteractionParameterizer