OpenMM
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This is the complete list of members for CustomGBForce, including all inherited members.
addComputedValue(const std::string &name, const std::string &expression, ComputationType type) | CustomGBForce | |
addEnergyTerm(const std::string &expression, ComputationType type) | CustomGBForce | |
addExclusion(int particle1, int particle2) | CustomGBForce | |
addFunction(const std::string &name, const std::vector< double > &values, double min, double max) | CustomGBForce | |
addGlobalParameter(const std::string &name, double defaultValue) | CustomGBForce | |
addParticle(const std::vector< double > ¶meters) | CustomGBForce | |
addPerParticleParameter(const std::string &name) | CustomGBForce | |
ComputationType enum name | CustomGBForce | |
createImpl() const | CustomGBForce | protectedvirtual |
CustomGBForce() | CustomGBForce | |
CutoffNonPeriodic enum value | CustomGBForce | |
CutoffPeriodic enum value | CustomGBForce | |
Force() | Force | inline |
getComputedValueParameters(int index, std::string &name, std::string &expression, ComputationType &type) const | CustomGBForce | |
getContextImpl(Context &context) | Force | protected |
getCutoffDistance() const | CustomGBForce | |
getEnergyTermParameters(int index, std::string &expression, ComputationType &type) const | CustomGBForce | |
getExclusionParticles(int index, int &particle1, int &particle2) const | CustomGBForce | |
getForceGroup() const | Force | |
getFunctionParameters(int index, std::string &name, std::vector< double > &values, double &min, double &max) const | CustomGBForce | |
getGlobalParameterDefaultValue(int index) const | CustomGBForce | |
getGlobalParameterName(int index) const | CustomGBForce | |
getImplInContext(Context &context) | Force | protected |
getNonbondedMethod() const | CustomGBForce | |
getNumComputedValues() const | CustomGBForce | inline |
getNumEnergyTerms() const | CustomGBForce | inline |
getNumExclusions() const | CustomGBForce | inline |
getNumFunctions() const | CustomGBForce | inline |
getNumGlobalParameters() const | CustomGBForce | inline |
getNumParticles() const | CustomGBForce | inline |
getNumPerParticleParameters() const | CustomGBForce | inline |
getParticleParameters(int index, std::vector< double > ¶meters) const | CustomGBForce | |
getPerParticleParameterName(int index) const | CustomGBForce | |
NoCutoff enum value | CustomGBForce | |
NonbondedMethod enum name | CustomGBForce | |
ParticlePair enum value | CustomGBForce | |
ParticlePairNoExclusions enum value | CustomGBForce | |
setComputedValueParameters(int index, const std::string &name, const std::string &expression, ComputationType type) | CustomGBForce | |
setCutoffDistance(double distance) | CustomGBForce | |
setEnergyTermParameters(int index, const std::string &expression, ComputationType type) | CustomGBForce | |
setExclusionParticles(int index, int particle1, int particle2) | CustomGBForce | |
setForceGroup(int group) | Force | |
setFunctionParameters(int index, const std::string &name, const std::vector< double > &values, double min, double max) | CustomGBForce | |
setGlobalParameterDefaultValue(int index, double defaultValue) | CustomGBForce | |
setGlobalParameterName(int index, const std::string &name) | CustomGBForce | |
setNonbondedMethod(NonbondedMethod method) | CustomGBForce | |
setParticleParameters(int index, const std::vector< double > ¶meters) | CustomGBForce | |
setPerParticleParameterName(int index, const std::string &name) | CustomGBForce | |
SingleParticle enum value | CustomGBForce | |
updateParametersInContext(Context &context) | CustomGBForce | |
~Force() | Force | inlinevirtual |