Hi where is the position of the partial charges? Is it in the center of the atom?
As one user of Gromacs, I can assign or write the partial chage for each atom in the .top file. How about changing the position of the partial charge? Thanks Lin _______________________________________________ gmx-users mailing list [email protected] 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
