On Tue, Apr 9, 2013 at 8:02 AM, Za Pour <za.p...@yahoo.com> wrote: > Dear All > I have done the lysozyme tutorial and at the end of the simulation a .gro > file have > been produced. would you please tell me whether this gro file contains the > structure > > of our molecules at the end of simulation or not? I mean does it show the > simulation > > box at the end of simulation? > > >From mdrun -h:
"The structure file (-c) contains the coordinates and velocities of the last step." -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
