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BALL::MMFF94ESParameters Member List

This is the complete list of members for BALL::MMFF94ESParameters, including all inherited members.

clear() | BALL::MMFF94ESParameters | virtual
equiv_ | BALL::MMFF94ParametersBase | protected
getIndex_(Position at1, Position at2, Position bt) const | BALL::MMFF94ESParameters | protected
getPartialCharge(Position at1, Position at2, Position bt) const | BALL::MMFF94ESParameters |
getPBCI(Index atom_type) const | BALL::MMFF94ESParameters |
getPhi(Index atom_type) const | BALL::MMFF94ESParameters |
is_initialized_ | BALL::MMFF94ParametersBase | protected
isInitialized() | BALL::MMFF94ParametersBase | inline
MMFF94ESParameters() | BALL::MMFF94ESParameters |
MMFF94ParametersBase() | BALL::MMFF94ParametersBase |
number_expected_fields_ | BALL::MMFF94ParametersBase | protected
operator=(const MMFF94ESParameters &param) | BALL::MMFF94ESParameters |
BALL::MMFF94ParametersBase::operator=(const MMFF94ParametersBase &) | BALL::MMFF94ParametersBase | inline
parameters_ | BALL::MMFF94ESParameters | protected
pbcis_ | BALL::MMFF94ESParameters | protected
phis_ | BALL::MMFF94ESParameters | protected
readEmpiricalParameters(Parameters &p, const String &section) | BALL::MMFF94ESParameters |
readParameters(Parameters &p, const String &section) | BALL::MMFF94ParametersBase |
setEquivalences(const MMFF94AtomTypeEquivalences &equi) | BALL::MMFF94ParametersBase | inline
setup_(const std::vector< std::vector< String > > &) | BALL::MMFF94ESParameters | protected virtual
~MMFF94ESParameters() | BALL::MMFF94ESParameters | virtual
~MMFF94ParametersBase() | BALL::MMFF94ParametersBase | inline virtual