Hello, What is the criteria for umbrella sampling convergence. If I am right, the pulling force and COM distance should be converged. I do not see force or COM distance convergence after 10ns of simulation.
Regards, Vijay
-- 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
