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38 #include "simulationinpututility.h"
40 #include "gromacs/fileio/checkpoint.h"
41 #include "gromacs/fileio/tpxio.h"
42 #include "gromacs/mdtypes/inputrec.h"
43 #include "gromacs/mdtypes/observableshistory.h"
44 #include "gromacs/mdtypes/state.h"
46 #include "simulationinput_impl.h"
51 void applyGlobalSimulationState(const SimulationInput& simulationInput,
52 PartialDeserializedTprFile* partialDeserializedTpr,
54 t_inputrec* inputRecord,
55 gmx_mtop_t* molecularTopology)
57 *partialDeserializedTpr = read_tpx_state(simulationInput.tprFilename_.c_str(), inputRecord,
58 globalState, molecularTopology);
61 void applyLocalState(const SimulationInput& simulationInput,
65 t_inputrec* inputRecord,
67 ObservablesHistory* observablesHistory,
68 bool reproducibilityRequested,
69 const MdModulesNotifier& mdModulesNotifier,
70 gmx::ReadCheckpointDataHolder* modularSimulatorCheckpointData,
71 const bool useModularSimulator)
73 load_checkpoint(simulationInput.cpiFilename_.c_str(), logfio, cr, dd_nc, inputRecord, state,
74 observablesHistory, reproducibilityRequested, mdModulesNotifier,
75 modularSimulatorCheckpointData, useModularSimulator);
78 } // end namespace gmx