Hi
I am trying to do NVT REMD simulations with gromacs. I have 60 replicas and each of them have different starting structure . The starting structures have same number of atoms but slightly different volume and pressure. I was able to run these simulations but I want to know if having different volume and pressure is affecting the exchange probability, and if it does, is it being included in the gromacs REMD simulations ? Please suggest a method to verify it . -- Regards Ruchi Lohia Graduate Student -- 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.
