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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 | |
| addTabulatedFunction(const std::string &name, TabulatedFunction *function) | 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 |
| getNumTabulatedFunctions() const | CustomGBForce | inline |
| getParticleParameters(int index, std::vector< double > ¶meters) const | CustomGBForce | |
| getPerParticleParameterName(int index) const | CustomGBForce | |
| getTabulatedFunction(int index) const | CustomGBForce | |
| getTabulatedFunction(int index) | CustomGBForce | |
| getTabulatedFunctionName(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 | |
| usesPeriodicBoundaryConditions() const | CustomGBForce | inlinevirtual |
| ~CustomGBForce() | CustomGBForce | |
| ~Force() | Force | inlinevirtual |