OpenMD 3.1
Molecular Dynamics in the Open
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This is the complete list of members for OpenMD::FluctuatingChargeObjectiveFunction, including all inherited members.
finiteDifferenceEpsilon() const | QuantLib::ObjectiveFunction | inlinevirtual |
FluctuatingChargeObjectiveFunction(SimInfo *info, ForceManager *forceMan, FluctuatingChargeConstraints *fqConstraints) (defined in OpenMD::FluctuatingChargeObjectiveFunction) | OpenMD::FluctuatingChargeObjectiveFunction | |
gradient(DynamicVector< RealType > &grad, const DynamicVector< RealType > &x) | OpenMD::FluctuatingChargeObjectiveFunction | virtual |
setInitialCoords() (defined in OpenMD::FluctuatingChargeObjectiveFunction) | OpenMD::FluctuatingChargeObjectiveFunction | |
value(const DynamicVector< RealType > &x) | OpenMD::FluctuatingChargeObjectiveFunction | virtual |
valueAndGradient(DynamicVector< RealType > &grad, const DynamicVector< RealType > &x) | OpenMD::FluctuatingChargeObjectiveFunction | virtual |
~ObjectiveFunction() (defined in QuantLib::ObjectiveFunction) | QuantLib::ObjectiveFunction | inlinevirtual |