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Gromacs
2025.4
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This is the complete list of members for gmx::FirstOrderPressureCoupling, including all inherited members.
| clientID() override | gmx::FirstOrderPressureCoupling | virtual |
| elementSetup() override | gmx::FirstOrderPressureCoupling | virtual |
| elementTeardown() override | gmx::FirstOrderPressureCoupling | inlinevirtual |
| FirstOrderPressureCoupling(int couplingFrequency, int couplingOffset, real couplingTimeStep, StatePropagatorData *statePropagatorData, EnergyData *energyData, FILE *fplog, const t_inputrec *inputrec, const MDAtoms *mdAtoms, t_nrnb *nrnb, ReportPreviousStepConservedEnergy reportPreviousStepConservedEnergy) | gmx::FirstOrderPressureCoupling | |
| getElementPointerImpl(LegacySimulatorData *legacySimulatorData, ModularSimulatorAlgorithmBuilderHelper *builderHelper, StatePropagatorData *statePropagatorData, EnergyData *energyData, FreeEnergyPerturbationData gmx_unused *freeEnergyPerturbationData, GlobalCommunicationHelper gmx_unused *globalCommunicationHelper, ObservablesReducer *observablesReducer, int offset, ReportPreviousStepConservedEnergy reportPreviousStepConservedEnergy) | gmx::FirstOrderPressureCoupling | static |
| restoreCheckpointState(std::optional< ReadCheckpointData > checkpointData, const t_commrec *cr) override | gmx::FirstOrderPressureCoupling | virtual |
| saveCheckpointState(std::optional< WriteCheckpointData > checkpointData, const t_commrec *cr) override | gmx::FirstOrderPressureCoupling | virtual |
| scheduleTask(Step step, Time time, const RegisterRunFunction &function) override | gmx::FirstOrderPressureCoupling | virtual |
| ~ICheckpointHelperClient()=default | gmx::ICheckpointHelperClient | virtual |
| ~ISimulatorElement()=default | gmx::ISimulatorElement | virtual |
1.8.5