Hi, usually I use something like: mdrun_mpi -v -deffnm topol_ -multi 72 -replex 1000 *-cpt* * * gromacs is smart enough to understand that it has to load topol_1.cpt topol_2.cpt ecc.ecc
Anyway, you can do a small test, i.e. using 5 replicas and stopping you simulation after a few seconds Francesco 2012/5/20 Tomek Wlodarski <tomek.wlodar...@gmail.com> > Hi, > > I am running REMD simulation: > > mdrun_mpi -v -deffnm -s topol_ -multi 72 -replex 1000 > > I am getting files with name like -s* (for example -s1.trr) > > How now I could restart this simulation? > I know that for regular MD simulation only I need -cpi cpt_file_name > --append to add, but what with REMD simulation (I have cpt file: for > example -s1_prev.cpt?) > > Something like: -cpi "-s" ?? > Thanks for suggestions! > Best! > > tomek > > -- > 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 > -- Cordiali saluti, Dr.Oteri Francesco
-- 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
