Dear Users, I know this error has been discussed many times but the outcome from mdrun -pf and -px stopped at the same time which is 39470 ps. Somehow gromacs caanot read pullx500.xvg but no clue why. I tried dos2gmx and still the same error occur.
As I do not care about pullx500.xvg I run grompp again to change the tpr file and set pull_nstxout = 0 then run from the checkpoint but then the error occurs that 4 out of 5 files to append are only present. Can you advise please? Steven -- gmx-users mailing list [email protected] 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 [email protected]. * Can't post? Read http://www.gromacs.org/Support/Mailing_Lists
