"max %d between two specific clusters\n", ntranst, maxtrans);
if (transfn)
{
- fp = ffopen(transfn, "w");
+ fp = gmx_ffopen(transfn, "w");
i = min(maxtrans+1, 80);
write_xpm(fp, 0, "Cluster Transitions", "# transitions",
"from cluster", "to cluster",
clust->ncl, clust->ncl, axis, axis, trans,
0, maxtrans, rlo, rhi, &i);
- ffclose(fp);
+ gmx_ffclose(fp);
}
if (ntransfn)
{
{
fprintf(fp, "%5d %5d\n", i+1, ntrans[i]);
}
- ffclose(fp);
+ gmx_ffclose(fp);
}
sfree(ntrans);
for (i = 0; i < clust->ncl; i++)
{
fprintf(fp, "%8g %8d\n", time[i], clust->cl[i]);
}
- ffclose(fp);
+ gmx_ffclose(fp);
}
if (sizefn)
{
{
fprintf(fp, "%10d %10g\n", i, eigenvalues[i]);
}
- ffclose(fp);
+ gmx_ffclose(fp);
break;
case m_monte_carlo:
orig = init_mat(rms->nn, FALSE);
bAverage, write_ncl, write_nst, rmsmin, bFit, log,
rlo_bot, rhi_bot, oenv);
}
- ffclose(log);
+ gmx_ffclose(log);
if (bBinary && !bAnalyze)
{
}
}
fprintf(stderr, "\n");
- ffclose(fp);
+ gmx_ffclose(fp);
if (NULL != orig)
{
fp = opt2FILE("-om", NFILE, fnm, "w");
write_xpm(fp, 0, title, "RMSD (nm)", buf, buf,
nf, nf, time, time, orig->mat, 0.0, orig->maxrms,
rlo_top, rhi_top, &nlevels);
- ffclose(fp);
+ gmx_ffclose(fp);
done_mat(&orig);
sfree(orig);
}