[gmx-users] g_rms -bin bug in version 3.1.4

Oliver Lange olange at gwdg.de
Fri Dec 19 19:25:01 CET 2003


Hi,

i don't know whether you have corrected that already in 3.2 but i found a small bug
in g_rms.c which occurs if you want to dump an asymmetric rms-matrix into a binary file 
with the option -bin.

line 702:
for(i=0;i<tel_mat;i++)
	  fwrite(rmsd_mat[i],sizeof(**rmsd_mat),tel_mat2,fp);
	--->  old line of code: write(rmsd_mat[i],sizeof(**rmsd_mat),tel_mat,fp);
	fclose(fp);
}

Cheers,
Oliver


----
Oliver Lange
MPI for biophysical Chemistry
olange at gwdg.de
Fax: +495512012302
Tel: +495512012305




More information about the gromacs.org_gmx-users mailing list