Dear All, for my original MD, based on mdp file the total time is 500 ps. After it finished, I have decided to extend the MD run to 2.5 ns.
I think the following command should be used: tpbconv -s original500ps.tpr -extend 2000 -o md-0.5ns-to-2.5ns.tpr But as for in the original mdp file the total time is 500 ps,is the "-extend 2000" workable in the "tpbconv -s original500ps.tpr -extend 2000 -o md-0.5ns-to-2.5ns.tpr"? Do I need to change the total time in the original mdp file from 500 ps to 2000 ps or a time period longer than 2000 ps, after the original 500 pd finished, in order to make "tpbconv -s original500ps.tpr -extend 2000 -o md-0.5ns-to-2.5ns.tpr" workable? I am looking forward to getting your reply. Cheers, Acoot -- 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
