Hi, I have strange situation. I am running MD with 4 replicas and when I recently checked the trajectory with gmxcheck in one replica I got this error:
Fatal error: Magic Number Error in XTC file (read 0, should be 1995) It is arround 50ns of the simulation, and right now I have 120ns. I would like to restart my simulation from the part before 50ns but I am not sure how to do this because my cpt file are written after 120ns... Can I generate new cpt file based on the part of the simulation before 50ns? Thanks for any suggestions. Best, tomek -- View this message in context: http://gromacs.5086.x6.nabble.com/restarting-MD-after-error-in-the-middle-of-trajectory-tp5013632.html Sent from the GROMACS Users Forum mailing list archive at Nabble.com. -- 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.
