Hi all, I have received an error message shown below.
Fatal error: No line with moleculetype 'SOL' found the [ molecules ] section of file 'topol.top' For more information and tips for troubleshooting, please check the GROMACS website at http://www.gromacs.org/Documentation/Errors I don't understand what's wrong with my topol.top file. I have included the following before the [ molecules ] section. [ moleculetype ] ; Name SOL 1 My [ molecules ] section looks like this: [ molecules ] ; Compound #mols Protein_chain_H 1 SOL 73337 Citrate 29 GLY 984 I have read the documentation and still don't understand. Please can you advise me on what to do? Many thanks, Akash -- 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.
