On Wed, 5 Oct 2016 09:28:16 +0000 Guanglin Kuang <guang...@kth.se> wrote:
> Dear Hannes, > > Part I: > ―――― > I have tried to use FESetup to generate the topology/coordinate files > for the mutated ligands, but I met some problems. Also, I do not recognize anything in your archive file that has been produced by FESetup. -- 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.