Gromacs
2024.4
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#include "gmxpre.h"
#include "simulationsignal.h"
#include <algorithm>
#include "gromacs/gmxlib/network.h"
#include "gromacs/mdrunutility/multisim.h"
#include "gromacs/mdtypes/commrec.h"
#include "gromacs/utility/arrayref.h"
#include "gromacs/utility/gmxassert.h"
#include "gromacs/utility/real.h"
This file defines functions for inter- and intra-simulation signalling by mdrun.
This handles details of responding to termination conditions, coordinating checkpoints, and coordinating multi-simulations.