Gromacs  2021.1
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Functions
#include <string>
#include "gromacs/timing/walltime_accounting.h"
+ Include dependency graph for pme_only.h:

Description

This file contains function declarations necessary for running on an MPI rank doing only PME long-ranged work.

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

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, const gmx::DeviceStreamManager *deviceStreamManager)
 Called on the nodes that do PME exclusively.