Generate an itp file for your molecule according to your force field. In the respective force field folder in aminoacids.rtp file define your molecule's atom name and bond connectivity and you are done.
On Sun, 7 Apr 2019, 1:24 am subrat ranjan tripathy, < subratlipatripathy...@gmail.com> wrote: > How to get rid of the fatal error when create the topol file for creaol? > How to find the paramiterise file for cresol? > -- > Gromacs Users mailing list > > * Please search the archive at > http://www.gromacs.org/Support/Mailing_Lists/GMX-Users_List before > posting! > > * Can't post? Read http://www.gromacs.org/Support/Mailing_Lists > > * For (un)subscribe requests visit > https://maillist.sys.kth.se/mailman/listinfo/gromacs.org_gmx-users or > send a mail to gmx-users-requ...@gromacs.org. > -- Gromacs Users mailing list * Please search the archive at http://www.gromacs.org/Support/Mailing_Lists/GMX-Users_List before posting! * Can't post? Read http://www.gromacs.org/Support/Mailing_Lists * For (un)subscribe requests visit https://maillist.sys.kth.se/mailman/listinfo/gromacs.org_gmx-users or send a mail to gmx-users-requ...@gromacs.org.
