BALL
1.4.79
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BALL
MMFF94VDWParameters
BALL::MMFF94VDWParameters Member List
This is the complete list of members for
BALL::MMFF94VDWParameters
, including all inherited members.
assignParameters
(Position at1, Position at2, double &rij, double &rij_7_, double &eij) const
BALL::MMFF94VDWParameters
calculated_
BALL::MMFF94VDWParameters
mutable
protected
clear
()
BALL::MMFF94VDWParameters
virtual
eij_
BALL::MMFF94VDWParameters
mutable
protected
equiv_
BALL::MMFF94ParametersBase
protected
getParameters
(Index at) const
BALL::MMFF94VDWParameters
getR
(Position atom_type) const
BALL::MMFF94VDWParameters
is_initialized_
BALL::MMFF94ParametersBase
protected
isInitialized
()
BALL::MMFF94ParametersBase
inline
MMFF94ParametersBase
()
BALL::MMFF94ParametersBase
MMFF94VDWParameters
()
BALL::MMFF94VDWParameters
number_expected_fields_
BALL::MMFF94ParametersBase
protected
operator=
(const MMFF94VDWParameters ¶m)
BALL::MMFF94VDWParameters
BALL::MMFF94ParametersBase::operator=
(const MMFF94ParametersBase &)
BALL::MMFF94ParametersBase
inline
parameters_
BALL::MMFF94VDWParameters
protected
readParameters
(Parameters &p, const String §ion)
BALL::MMFF94ParametersBase
rij_
BALL::MMFF94VDWParameters
mutable
protected
rij_7_
BALL::MMFF94VDWParameters
mutable
protected
rs_
BALL::MMFF94VDWParameters
mutable
protected
setEquivalences
(const MMFF94AtomTypeEquivalences &equi)
BALL::MMFF94ParametersBase
inline
setup_
(const std::vector< std::vector< String > > &)
BALL::MMFF94VDWParameters
protected
virtual
~MMFF94ParametersBase
()
BALL::MMFF94ParametersBase
inline
virtual
~MMFF94VDWParameters
()
BALL::MMFF94VDWParameters
virtual
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