Dear, all I find there are some small molecule's itp file in /gromacs/share/gromacs/top/; some of them seem belong to united atom force field, others of them seem belong to all-atom force field. Now, the question is, most of them has no note about which force field it belongs to, how can I know which is the compatible force field for them, Especially for benzamide.itp --It should be include in a all-atom force field, I want to use it together with other parameters in opls-aa force field, will it be problematic?
Thank you! HongJun Bai, graduate student, Center for Theoretical Biology, Peking University, Beijing, P.R.China [EMAIL PROTECTED] _______________________________________________ gmx-users mailing list gmx-users@gromacs.org 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
