Hi, There's nothing in GROMACS that specifically supports reweighting replica-exchange simulations.
Mark On 03/04/2015 10:03 am, "NISHA Prakash" <nishnith20...@gmail.com> wrote: > Hi, > > Can somebody please help with WHAM reweighting scheme for REMD analysis. > The command "gmx wham" works for Umbrella sampling simulation but I couldnt > find a way out for T-REMD. > There are similar questions which have been posted here but unfortunately, > I haven't found answers for the same. > WHAM for REMD has been well documented for AMBER but I couldnt find any > help for Gromacs. > I am a novice in the field and help is appreciated. > > Thanks! > > Nisha > -- > 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. > -- 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.