Hello all, Is there a way to use the free energy code with position restraints (similar to the way that the free energy code interacts with the pull code)? From the manual all I can see that might be relevant is "restraint-lambdas" but that is apparently only for "dihedral restraints, and the pull code restraints".
I would like to use position restraints instead of other methods (like pull or umbrella) because I am using the position restraints to maintain an ice layer with many atoms while also using NPT ensemble. Any suggestions are appreciated. Thanks, Dan -- 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.
