Hi Sarbani, Use tpbconv. You can only (properly) restart from a point where you have a frame with velocities (in the .trr file) and preferrably energies (.edr).
Best, Tsjerk On 8 Oct 2007 12:34:23 -0000, sarbani chattopadhyay < [EMAIL PROTECTED]> wrote: > > > hi, > I have been running a molecular dynamics simulation for 2 > nanoseconds.But it stopped in > the middle because of an internal problem.Is there any way to restart the > simulation from > the point it has stopped? > > Thank all > > Sarbani > > > > _______________________________________________ > gmx-users mailing list gmx-users@gromacs.org > http://www.gromacs.org/mailman/listinfo/gmx-users > Please search the archive at http://www.gromacs.org/search before posting! > Please don't post (un)subscribe requests to the list. Use the > www interface or send it to [EMAIL PROTECTED] > Can't post? Read http://www.gromacs.org/mailing_lists/users.php > -- Tsjerk A. Wassenaar, Ph.D. Junior UD (post-doc) Biomolecular NMR, Bijvoet Center Utrecht University Padualaan 8 3584 CH Utrecht The Netherlands P: +31-30-2539931 F: +31-30-2537623
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