On Mon, Apr 8, 2013 at 9:08 AM, Rasoul Nasiri <nasiri1...@gmail.com> wrote:
> Bellow is my command which I used: > > g_clustsize_d -f traj.xtc -s topol.tpr -n n.ndx -nc nclust.xvg -mc > maxclust > .xvg -ac avclust.xvg -mcn maxclust.ndx -cut 0.516 -temp Tempe.xvg > > Then it is exactly what I said. Temperatures require velocities. Velocities are not stored in .xtc files and thus you can't extract any temperature information in this way. -Justin -- ======================================== Justin A. Lemkul, Ph.D. Research Scientist Department of Biochemistry Virginia Tech Blacksburg, VA jalemkul[at]vt.edu | (540) 231-9080http://www.bevanlab.biochem.vt.edu/Pages/Personal/justin ======================================== -- gmx-users mailing list gmx-users@gromacs.org http://lists.gromacs.org/mailman/listinfo/gmx-users * Please search the archive at http://www.gromacs.org/Support/Mailing_Lists/Search before posting! * Please don't post (un)subscribe requests to the list. Use the www interface or send it to gmx-users-requ...@gromacs.org. * Can't post? Read http://www.gromacs.org/Support/Mailing_Lists
