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BALL::MolecularInteractions Member List

This is the complete list of members for BALL::MolecularInteractions, including all inherited members.

addInteraction(const Atom *atom, String interaction_type, double energy) | BALL::MolecularInteractions |
addInteraction(String interaction_type, double energy) | BALL::MolecularInteractions |
clear() | BALL::MolecularInteractions |
getInteractionEnergy(const Atom *atom, String interaction_type) const | BALL::MolecularInteractions |
getInteractionEnergy(const Atom *atom, const list< String > &interaction_types) const | BALL::MolecularInteractions |
getInteractionEnergy(String interaction_type) const | BALL::MolecularInteractions |
getInteractionEnergy(const std::list< String > &interaction_types) const | BALL::MolecularInteractions |
getInteractionEnergy() const | BALL::MolecularInteractions |
getInteractions(String interaction_type) const | BALL::MolecularInteractions |
getInteractions(const std::list< String > &interaction_types, std::map< const Atom *, double > &interactions) const | BALL::MolecularInteractions |
hasInteraction(const Atom *atom, String interaction_type) const | BALL::MolecularInteractions |
MolecularInteractions() | BALL::MolecularInteractions |
SAVE_ONLY_SUMS | BALL::MolecularInteractions | static
setThreshold(double threshold) | BALL::MolecularInteractions |