IS this a problem? *System has non-zero total charge: -8.000001e+00*
If yes, can I fix that changing COulomb cutt-off to PME electrostatics? THanks!!
-- gmx-users mailing list gmx-users@gromacs.org http://lists.gromacs.org/mailman/listinfo/gmx-users Please search the archive at http://www.gromacs.org/search before posting! Please don't post (un)subscribe requests to the list. Use the www interface or send it to gmx-users-requ...@gromacs.org. Can't post? Read http://www.gromacs.org/mailing_lists/users.php
