Ok, then i would take to following parameters: _x is vdw or coulomb
rlist 1.7 (must be greater then r_x) r_x 1.4 r_x_switch 0.8 x_type shift right?!? Thomas _______________________________________________ gmx-users mailing list gmx-users@gromacs.org http://www.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 [EMAIL PROTECTED] Can't post? Read http://www.gromacs.org/mailing_lists/users.php