Hi all, >From the Gromacs Manual -- 3.10.1 Steepest Descent -- The notation max(|Fn|) means the largest of the absolute values of the force components.
Does this mean that (1) for a specific atoms, the largest absolute value of its force components, or (2) after vector addition of forces of each atom in the system, find out the maximum force component in the system force matrix Fn -- Yanke Peng Visiting Ph. D Candidate Department of Mechanical Engineering, University of Minnesota -- 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.
