Hi all, is it possible in the topology file to have (compination rule=1) and have under the [nonbond_params] both LJ potentials and Buckingham potentials. please let me know. i am doing that but i get some warnings after "grompp" procedure.
thanks in advance Argyris Karatrantos _______________________________________________ gmx-users mailing list [email protected] http://www.gromacs.org/mailman/listinfo/gmx-users 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/mailing_lists/users.php
