-replex 100 should emit to the log file every 100 steps. What was your nstlog? Are you sure you are checking the right files? Can you reproduce it?
Mark On Tue, Jul 30, 2013 at 8:36 PM, Dejun Lin <dejun....@gmail.com> wrote: > Hi all, > > I'm running a replica exchange simulation using gromacs 4.6.3 with the > command line: > > mdrun_mpi -deffnm remd_ -multi 64 -replex 100 -nex 262144 > > I was expecting to get a log entry about the exchange every 100 steps but I > only got one every 1000 steps. I wonder if the output was suppressed > somehow or it was not exchanging at the right frequency? > > Thanks, > Dejun > -- > 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 -- 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
