BALL
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BALL
NonpolarSolvation
BALL::NonpolarSolvation Member List
This is the complete list of members for
BALL::NonpolarSolvation
, including all inherited members.
atom_pairwise_
BALL::ScoringComponent
protected
base_function_
BALL::ScoringComponent
protected
CALCULATION__NONE
enum value
BALL::NonpolarSolvation
CALCULATION__PCM
enum value
BALL::NonpolarSolvation
CALCULATION__UHLIG
enum value
BALL::NonpolarSolvation
CALCULATION__VDW_INTERACTION
enum value
BALL::NonpolarSolvation
CALCULATION__VDW_SOLVENT
enum value
BALL::NonpolarSolvation
CalculationMethod
enum name
BALL::NonpolarSolvation
clear
()
BALL::NonpolarSolvation
virtual
coefficient_
BALL::ScoringComponent
protected
disable
()
BALL::ScoringComponent
enable
()
BALL::ScoringComponent
enabled_
BALL::ScoringComponent
protected
getCoefficient
()
BALL::ScoringComponent
getName
() const
BALL::ScoringComponent
getNormalizationParameters
(double &stddev, double &mean)
BALL::ScoringComponent
getRawScore
() const
BALL::ScoringComponent
getScaledScore
() const
BALL::ScoringComponent
getScoringFunction
() const
BALL::ScoringComponent
getTypeName
()
BALL::ScoringComponent
gridable_
BALL::ScoringComponent
protected
isAtomPairwise
()
BALL::ScoringComponent
isEnabled
()
BALL::ScoringComponent
isGridable
()
BALL::ScoringComponent
isLigandIntraMolecular
()
BALL::ScoringComponent
ligand_intra_molecular_
BALL::ScoringComponent
protected
mean_
BALL::ScoringComponent
protected
NonpolarSolvation
()
BALL::NonpolarSolvation
NonpolarSolvation
(ScoringFunction &sf)
BALL::NonpolarSolvation
NonpolarSolvation
(const NonpolarSolvation &fhb)
BALL::NonpolarSolvation
operator=
(const NonpolarSolvation &fr)
BALL::NonpolarSolvation
operator==
(const NonpolarSolvation &fr) const
BALL::NonpolarSolvation
scaleScore
(double score) const
BALL::ScoringComponent
protected
score_
BALL::ScoringComponent
protected
scoring_function_
BALL::ScoringComponent
protected
ScoringComponent
()
BALL::ScoringComponent
ScoringComponent
(const ScoringComponent &sc)
BALL::ScoringComponent
ScoringComponent
(ScoringFunction &sf)
BALL::ScoringComponent
selectBaseFunction
(String function)
BALL::ScoringComponent
setCoefficient
(const double &coeff)
BALL::ScoringComponent
setLigandIntraMolecular
(bool b)
BALL::ScoringComponent
virtual
setName
(const String &name)
BALL::ScoringComponent
setNormalizationParameters
(double stddev, double mean)
BALL::ScoringComponent
setScoringFunction
(ScoringFunction &sf)
BALL::ScoringComponent
setup
()
BALL::NonpolarSolvation
virtual
setupLigand
()
BALL::ScoringComponent
virtual
stddev_
BALL::ScoringComponent
protected
type_name_
BALL::ScoringComponent
protected
update
(const vector< std::pair< Atom *, Atom * > > &pair_vector)
BALL::NonpolarSolvation
virtual
updateScore
()
BALL::NonpolarSolvation
virtual
~NonpolarSolvation
()
BALL::NonpolarSolvation
virtual
~ScoringComponent
()
BALL::ScoringComponent
virtual
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