C++ (Cpp) bc_pull_group Examples

Example #1

File: mvdata.c Project: rbharath/gromacs

static void bc_pull(const t_commrec *cr, t_pull *pull)
{
    int g;

    block_bc(cr, *pull);
    snew_bc(cr, pull->group, pull->ngroup);
    for (g = 0; g < pull->ngroup; g++)
    {
        bc_pull_group(cr, &pull->group[g]);
    }
    snew_bc(cr, pull->coord, pull->ncoord);
    nblock_bc(cr, pull->ncoord, pull->coord);
}

Example #2

File: broadcaststructs.cpp Project: MichalKononenko/gromacs

static void bc_pull(const t_commrec *cr, pull_params_t *pull)
{
    int g;

    block_bc(cr, *pull);
    snew_bc(cr, pull->group, pull->ngroup);
    for (g = 0; g < pull->ngroup; g++)
    {
        bc_pull_group(cr, &pull->group[g]);
    }
    snew_bc(cr, pull->coord, pull->ncoord);
    nblock_bc(cr, pull->ncoord, pull->coord);
    for (int c = 0; c < pull->ncoord; c++)
    {
        if (!MASTER(cr))
        {
            pull->coord[c].externalPotentialProvider = NULL;
        }
        if (pull->coord[c].eType == epullEXTERNAL)
        {
            bc_cstring(cr, &pull->coord[c].externalPotentialProvider);
        }
    }
}