Hi, I want to simulate a protein-ligand complex with implicit solvent. After I ran "grompp" command it prompted me there were some missing GB parameters. I guess the problem is that some atom types in my system are not included in the gbsa.itp file. If it is the case, do you know where can I find the missing GB parameters? Especially the Mg and P elements.
Thank you in advance! Dading Huang -- 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.
