Hi all In umbrella sampling simulations: If pull_geometry = direction, and pull_vec is obviously a specified vector, does the distance between the two groups only vary along that vector? i.e Is the umbrella potential only defined along that vector?
Many Thanks Gavin -- gmx-users mailing list [email protected] http://lists.gromacs.org/mailman/listinfo/gmx-users Please search the archive at http://www.gromacs.org/Support/Mailing_Lists/Search before posting! Please don't post (un)subscribe requests to the list. Use the www interface or send it to [email protected]. Can't post? Read http://www.gromacs.org/Support/Mailing_Lists
