assignParameters(Position type_index, Index at1, Index at2, Index at3, Index at4, double &v1, double &v2, double &v3) const | BALL::MMFF94TorsionParameters | |
buffered_parameters_ | BALL::MMFF94TorsionParameters | mutableprotected |
clear() | BALL::MMFF94TorsionParameters | virtual |
equiv_ | BALL::MMFF94ParametersBase | protected |
getIndex_(Position type, Position atom_type1, Position atom_type2, Position atom_type3, Position atom_type4) const | BALL::MMFF94TorsionParameters | protected |
ic_ | BALL::MMFF94TorsionParameters | protectedstatic |
is_initialized_ | BALL::MMFF94ParametersBase | protected |
isInitialized() | BALL::MMFF94ParametersBase | inline |
lc_ | BALL::MMFF94TorsionParameters | protectedstatic |
MMFF94ParametersBase() | BALL::MMFF94ParametersBase | |
MMFF94TorsionParameters() | BALL::MMFF94TorsionParameters | |
number_expected_fields_ | BALL::MMFF94ParametersBase | protected |
operator=(const MMFF94TorsionParameters ¶m) | BALL::MMFF94TorsionParameters | |
BALL::MMFF94ParametersBase::operator=(const MMFF94ParametersBase &) | BALL::MMFF94ParametersBase | inline |
parameters_ | BALL::MMFF94TorsionParameters | protected |
readParameters(Parameters &p, const String §ion) | BALL::MMFF94ParametersBase | |
setEquivalences(const MMFF94AtomTypeEquivalences &equi) | BALL::MMFF94ParametersBase | inline |
setup_(const vector< vector< String > > &) | BALL::MMFF94TorsionParameters | protectedvirtual |
TorsionsMap typedef | BALL::MMFF94TorsionParameters | |
~MMFF94ParametersBase() | BALL::MMFF94ParametersBase | inlinevirtual |
~MMFF94TorsionParameters() | BALL::MMFF94TorsionParameters | virtual |