simulationsignal.cpp File Reference

#include "gmxpre.h"
#include "simulationsignal.h"
#include <cstddef>
#include <algorithm>
#include <iterator>
#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"

Include dependency graph for simulationsignal.cpp:

Description

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.

Todo:

Move this to mdrunutility module alongside gathering multi-simulation communication infrastructure there.

Author

Berk Hess hess@.nosp@m.kth..nosp@m.se

Mark Abraham mark..nosp@m.j.ab.nosp@m.raham.nosp@m.@gma.nosp@m.il.co.nosp@m.m