Dear All, I noticed that after my minimization run I have less snapshots in trr than I expected. For instance, the structure is written every 126-127 steps (plus the last one) even though my mdp file states
nstxout = 100 Best wishes, Dawid Grabarek -- 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 [email protected].
