Dear Gromacs, I would like to extend my simulation. 200 ns was put in the "md.mdp" file, which was used to build "md_0_1.tpr".
Then, I use "mdrun -deffnm md_0_1" to submit "md_0_1.tpr". Due to the limitation on our cluster, only 5 ns (for example) was simulated when the job finishes. The "md_0_1.tpr" file is NOT changed, and I got other new files but WITHOUT a cpt file (why?): ) md_0_1.trr ) md_0_1.xtc ) md_0_1.edr ) md_0_1.log So I want to continue the simulation from the end of 5 ns. How should I do this? I am not quite sure if I understand correctly from http://www.gromacs.org/Documentation/How-tos/Extending_Simulations, and I also feel this link does not address my problem, as the tpr file was not changed in my case. Thank you. Yours sincerely Cheng -- Gromacs Users mailing list * Please search the archive at http://www.gromacs.org/Support/Mailing_Lists/GMX-Users_List before posting! * Can't post? Read http://www.gromacs.org/Support/Mailing_Lists * For (un)subscribe requests visit https://maillist.sys.kth.se/mailman/listinfo/gromacs.org_gmx-users or send a mail to gmx-users-requ...@gromacs.org.