> Dear all > I want to put restraint on peptide bond and analyse in both cis and trans > form. > > But hor to put these restraints??
Do be aware that constraints and restraints are different things in GROMACS. Please see Chapter 5 for information on both. Mark _______________________________________________ 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