BALL  1.4.2
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BALL::SLICKEnergy Member List

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

base_function_BALL::ScoringFunctionprotected
calculateScore()BALL::ScoringFunction
clear()BALL::SLICKEnergyvirtual
components_BALL::ScoringFunctionprotected
getBaseFunction() const BALL::ScoringFunction
getCHPIScore() const BALL::SLICKEnergy
getCoefficient(const ScoringComponent *component, float &coefficient) const BALL::ScoringFunction
getCoefficient(const String &name, float &coefficient) const BALL::ScoringFunction
getComponent(const String &name) const BALL::ScoringFunction
getComponent(const Size index) const BALL::ScoringFunction
getFirstMolecule() const BALL::ScoringFunction
getHydrogenBondScore() const BALL::SLICKEnergy
getIntercept() const BALL::ScoringFunction
getLigand() const BALL::ScoringFunction
getMaximumNumberOfErrors() const BALL::ScoringFunction
getNonpolarSolvationScore() const BALL::SLICKEnergy
getPolarSolvationScore() const BALL::SLICKEnergy
getReceptor() const BALL::ScoringFunction
getSecondMolecule() const BALL::ScoringFunction
getUnassignedAtoms() const BALL::ScoringFunction
getUnassignedAtoms()BALL::ScoringFunction
getVDWScore() const BALL::SLICKEnergy
insertComponent(ScoringComponent *component, float coefficient=1.0f)BALL::ScoringFunction
intercept_BALL::ScoringFunctionprotected
max_number_of_errors_BALL::ScoringFunctionprotected
molecule1_BALL::ScoringFunctionprotected
molecule2_BALL::ScoringFunctionprotected
name_BALL::ScoringFunctionprotected
number_of_errors_BALL::ScoringFunctionprotected
operator=(const SLICKEnergy &slick)BALL::SLICKEnergy
BALL::ScoringFunction::operator=(const ScoringFunction &sf)BALL::ScoringFunction
optionsBALL::ScoringFunction
registerComponents_()BALL::SLICKEnergyprivate
removeComponent(const ScoringComponent *component)BALL::ScoringFunction
removeComponent(const String &name)BALL::ScoringFunction
score_BALL::ScoringFunctionprotected
ScoringFunction()BALL::ScoringFunction
ScoringFunction(const ScoringFunction &sf)BALL::ScoringFunction
ScoringFunction(Molecule &receptor, Molecule &ligand)BALL::ScoringFunction
ScoringFunction(Molecule &receptor, Molecule &ligand, const Options &options)BALL::ScoringFunction
setBaseFunction(ScoringBaseFunction &base_function)BALL::ScoringFunction
setCoefficient(const ScoringComponent *component, float coefficient)BALL::ScoringFunction
setCoefficient(const String &name, float coefficient)BALL::ScoringFunction
setFirstMolecule(Molecule &molecule1)BALL::ScoringFunction
setIntercept(double intercept)BALL::ScoringFunction
setLigand(Molecule &ligand)BALL::ScoringFunction
setMaximumNumberOfErrors(Size nr)BALL::ScoringFunction
setReceptor(Molecule &receptor)BALL::ScoringFunction
setSecondMolecule(Molecule &molecule2)BALL::ScoringFunction
setup()BALL::ScoringFunction
setup(Molecule &receptor, Molecule &ligand)BALL::ScoringFunction
setup(Molecule &receptor, Molecule &ligand, const Options &options)BALL::ScoringFunction
SLICKEnergy()BALL::SLICKEnergy
SLICKEnergy(Molecule &protein, Molecule &ligand)BALL::SLICKEnergy
SLICKEnergy(Molecule &protein, Molecule &ligand, const Options &options)BALL::SLICKEnergy
SLICKEnergy(const SLICKEnergy &slick)BALL::SLICKEnergy
specificSetup()BALL::SLICKEnergyvirtual
unassigned_atoms_BALL::ScoringFunctionprotected
~ScoringFunction()BALL::ScoringFunctionvirtual
~SLICKEnergy()BALL::SLICKEnergyvirtual