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BALL::MMFF94StretchBendParameters Member List

This is the complete list of members for BALL::MMFF94StretchBendParameters, including all inherited members.

assignParameters(Position stretch_bend_type, const Atom &atom1, const Atom &atom2, const Atom &atom3, double &kba_ijk, double &kba_kji) const | BALL::MMFF94StretchBendParameters |
buffered_parameters_ | BALL::MMFF94StretchBendParameters | mutable protected
clear() | BALL::MMFF94StretchBendParameters | virtual
equiv_ | BALL::MMFF94ParametersBase | protected
getIndex_(Position stretch_bend_type, Position atom_type1, Position atom_type2, Position atom_type3) const | BALL::MMFF94StretchBendParameters | protected
getIndexByRow_(Position r1, Position r2, Position r3) const | BALL::MMFF94StretchBendParameters | protected
is_initialized_ | BALL::MMFF94ParametersBase | protected
isInitialized() | BALL::MMFF94ParametersBase | inline
MMFF94ParametersBase() | BALL::MMFF94ParametersBase |
MMFF94StretchBendParameters() | BALL::MMFF94StretchBendParameters |
number_expected_fields_ | BALL::MMFF94ParametersBase | protected
operator=(const MMFF94StretchBendParameters &param) | BALL::MMFF94StretchBendParameters |
BALL::MMFF94ParametersBase::operator=(const MMFF94ParametersBase &) | BALL::MMFF94ParametersBase | inline
parameters_ | BALL::MMFF94StretchBendParameters | protected
parameters_by_row_ | BALL::MMFF94StretchBendParameters | protected
readEmpiricalParameters(Parameters &p, const String &section) | BALL::MMFF94StretchBendParameters |
readParameters(Parameters &p, const String &section) | BALL::MMFF94ParametersBase |
setEquivalences(const MMFF94AtomTypeEquivalences &equi) | BALL::MMFF94ParametersBase | inline
setup_(const std::vector< std::vector< String > > &) | BALL::MMFF94StretchBendParameters | protected virtual
StretchBendMap typedef | BALL::MMFF94StretchBendParameters |
~MMFF94ParametersBase() | BALL::MMFF94ParametersBase | inline virtual
~MMFF94StretchBendParameters() | BALL::MMFF94StretchBendParameters | virtual