Justin Lemkul <jalemkul@...> writes: > > Use mdrun -nt 1 >
Thank you for a quick reply - however, I really need to parallelize - single CPU run would take ages;) Regards, Jan -- 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.