Hi, In general, GROMACS supports only two-body interactions (apart from various well known multi-body bond-style interactions), so unfortunately there is no way to do what you want.
Mark On Thu., 27 Jun. 2019, 07:50 Divya Rai, <drai...@gmail.com> wrote: > I wanted to know how is it possible to model a user-defined potential and > run MD simulation through Gromacs? The tabulated potential has a specific > form as defined in the manuals. What if my potential lacks it? Taking an > example of Muller-Brown, how can I use Muller Brown potential for my MD > simulations through Gromacs? > Kindly help. > -- > 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.
