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Searched refs:estBOX (Results 1 – 5 of 5) sorted by relevance

/dports/science/gromacs/gromacs-2021.4/src/gromacs/mdlib/
H A Dbroadcaststructs.cpp83 case estBOX: block_bc(communicator, state->box); break; in broadcastStateWithoutDynamics()
H A Dmd_support.cpp552 state->flags |= (1 << estBOX); in set_state_entries()
/dports/science/gromacs/gromacs-2021.4/src/gromacs/mdtypes/
H A Dstate.h99 estBOX, enumerator
/dports/science/gromacs/gromacs-2021.4/src/gromacs/modularsimulator/
H A Dstatepropagatordata.cpp260 state->flags = (1U << estX) | (1U << estV) | (1U << estBOX); in localState()
/dports/science/gromacs/gromacs-2021.4/src/gromacs/fileio/
H A Dcheckpoint.cpp1289 case estBOX: ret = do_cpte_matrix(xd, part, i, sflags, state->box, list); break; in do_cpt_state()
2937 fr->bBox = ((state.flags & (1 << estBOX)) != 0); in read_checkpoint_trxframe()