Hey; Go through the link <http://manual.gromacs.org/online/mdp_opt.html#bond>. You will get everything about your purpose. By the way, you could use *constraints=none . *But you have to make sure you use proper *timestep* while using no constraint.
--Masrul On Sun, Oct 16, 2016 at 4:24 AM, Mouri Ahmed <mouriahmed...@gmail.com> wrote: > Hi > > I want to use no constraint in my MD simulation. What will I write in my > mdp file? > > Best Regards > Mouri > -- > 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.
