Hi all! I encounter this error while running pdb2gmx on GROMACS3.3.1 with ffG53a6m il forcefield modificato per la reverse transformation.
Fatal error: Residue 'NME' not found in residue topology database I know I should add it to the .rtp file, but I don't know exactly how to do that, any help? Otherwise, I'm actually just looking for a toy system with which just play around as I'm having issues with the reverse transformation. Any suggestion for a pdb? thanks! -- Francesca Vitalini PhD student at Computational Molecular Biology Group, Department of Mathematics and Informatics, FU-Berlin Arnimallee 6 14195 Berlin [email protected] [email protected] +49 3083875776 +49 3083875412 -- gmx-users mailing list [email protected] http://lists.gromacs.org/mailman/listinfo/gmx-users Please search the archive at http://www.gromacs.org/Support/Mailing_Lists/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/Support/Mailing_Lists
