Hi, I would like to know if there a way to do an isolated protein simulation (without periodic boundary conditions) and in that case, how can I choose the bondary conditions. I`ve been reading editconf opcion -pbc, and pbc = no in the .mdp files, but it doesn`t seems to work. Hopping to be clear, Thanks in advance!
Andy
_______________________________________________ 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