Dear users I'm trying to build the topology files for a box with 1000 molecules of water and an organic molecule.
when I use pdb2gmx come out the error: "OUB7 not found in residue topology database" how do I put this residue in the database? I have a .itp file for this molecule. I use gromacs 5.0.4. Best regards. -- 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.
