CDPL::ForceField::MMFF94StretchBendInteraction Member List

This is the complete list of members for CDPL::ForceField::MMFF94StretchBendInteraction, including all inherited members.

getAtom1Index() const	CDPL::ForceField::MMFF94StretchBendInteraction	inline
getAtom2Index() const	CDPL::ForceField::MMFF94StretchBendInteraction	inline
getAtom3Index() const	CDPL::ForceField::MMFF94StretchBendInteraction	inline
getCenterAtomIndex() const	CDPL::ForceField::MMFF94StretchBendInteraction	inline
getIJKForceConstant() const	CDPL::ForceField::MMFF94StretchBendInteraction	inline
getKJIForceConstant() const	CDPL::ForceField::MMFF94StretchBendInteraction	inline
getReferenceAngle() const	CDPL::ForceField::MMFF94StretchBendInteraction	inline
getReferenceLength1() const	CDPL::ForceField::MMFF94StretchBendInteraction	inline
getReferenceLength2() const	CDPL::ForceField::MMFF94StretchBendInteraction	inline
getStretchBendTypeIndex() const	CDPL::ForceField::MMFF94StretchBendInteraction	inline
getTerminalAtom1Index() const	CDPL::ForceField::MMFF94StretchBendInteraction	inline
getTerminalAtom2Index() const	CDPL::ForceField::MMFF94StretchBendInteraction	inline
MMFF94StretchBendInteraction(std::size_t term_atom1_idx, std::size_t ctr_atom_idx, std::size_t term_atom2_idx, unsigned int sb_type_idx, double ref_angle, double ref_length1, double ref_length2, double ijk_force_const, double kji_force_const)	CDPL::ForceField::MMFF94StretchBendInteraction	inline
setReferenceAngle(double angle)	CDPL::ForceField::MMFF94StretchBendInteraction	inline
setReferenceLength1(double length)	CDPL::ForceField::MMFF94StretchBendInteraction	inline
setReferenceLength2(double length)	CDPL::ForceField::MMFF94StretchBendInteraction	inline