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gmx::VelocityScalingTemperatureCoupling Member List

This is the complete list of members for gmx::VelocityScalingTemperatureCoupling, including all inherited members.

clientID() overridegmx::VelocityScalingTemperatureCouplingvirtual
connectWithMatchingPropagator(const PropagatorConnection &connectionData, const PropagatorTag &propagatorTag)gmx::VelocityScalingTemperatureCoupling
elementSetup() overridegmx::VelocityScalingTemperatureCouplingvirtual
elementTeardown() overridegmx::VelocityScalingTemperatureCouplinginlinevirtual
getElementPointerImpl(LegacySimulatorData *legacySimulatorData, ModularSimulatorAlgorithmBuilderHelper *builderHelper, StatePropagatorData *statePropagatorData, EnergyData *energyData, FreeEnergyPerturbationData *freeEnergyPerturbationData, GlobalCommunicationHelper *globalCommunicationHelper, ObservablesReducer *observablesReducer, Offset offset, UseFullStepKE useFullStepKE, ReportPreviousStepConservedEnergy reportPreviousStepConservedEnergy, const PropagatorTag &propagatorTag)gmx::VelocityScalingTemperatureCouplingstatic
restoreCheckpointState(std::optional< ReadCheckpointData > checkpointData, const t_commrec *cr) overridegmx::VelocityScalingTemperatureCouplingvirtual
saveCheckpointState(std::optional< WriteCheckpointData > checkpointData, const t_commrec *cr) overridegmx::VelocityScalingTemperatureCouplingvirtual
scheduleTask(Step step, Time time, const RegisterRunFunction &registerRunFunction) overridegmx::VelocityScalingTemperatureCouplingvirtual
VelocityScalingTemperatureCoupling(int nstcouple, int offset, UseFullStepKE useFullStepKE, ReportPreviousStepConservedEnergy reportPreviousConservedEnergy, int64_t seed, int numTemperatureGroups, double couplingTimeStep, const real *referenceTemperature, const real *couplingTime, const real *numDegreesOfFreedom, EnergyData *energyData, TemperatureCoupling couplingType)gmx::VelocityScalingTemperatureCoupling
~ICheckpointHelperClient()=defaultgmx::ICheckpointHelperClientvirtual
~IEnergySignallerClient()=defaultgmx::IEnergySignallerClientvirtual
~ISimulatorElement()=defaultgmx::ISimulatorElementvirtual