Gromacs
2024.4
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#include <string>
#include "gromacs/timing/walltime_accounting.h"
This file contains function declarations necessary for running on an MPI rank doing only PME long-ranged work.
Functions | |
int | gmx_pmeonly (gmx_pme_t **pme, const t_commrec *cr, t_nrnb *mynrnb, gmx_wallcycle *wcycle, gmx_walltime_accounting_t walltime_accounting, t_inputrec *ir, PmeRunMode runMode, bool useGpuPmePpCommunication, bool useNvshmem, const gmx::DeviceStreamManager *deviceStreamManager) |
Called on the nodes that do PME exclusively. | |