Hello, Basically is telling you that the output (.tpr) file that grompp should have created is not there to be read.
Check if grompp ran correctly and produced the wanted output. I suspect that it may have failed for some reasons. Hope this helps, Cheers, Davide On 19/10/12 7:37 PM, "Albert" <[email protected]> wrote: >hello: > >I am trying to submit replica exchange jobs to cluster by following >command, but failed: > >g_tune_pme_d -x -np 128 mdrun -s remd_.tpr -multi 16 -replex 1000 >-reseed -1 -launch > >Here is the log file: > >------------------------------------------------------- >Program g_tune_pme_d, VERSION 4.5.5 >Source code file: gmx_tune_pme.c, line: 1579 > >Fatal error: >File remd_.tpr not found. >For more information and tips for troubleshooting, please check the >GROMACS >website at http://www.gromacs.org/Documentation/Errors >------------------------------------------------------- > > >I've got all necessary .tpr file in the same directory (remd_1.tpr, >remd_2.tpr ......) > >thank you very much >Albert >-- >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 -- 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
