Program g_hbond, VERSION 4.5.4 Source code file: gmx_hbond.c, line: 823 Fatal error: No donor atom 5226
On Wed, Jul 10, 2013 at 10:58 AM, yunshi11 . <yunsh...@gmail.com> wrote: > Hi all, > > I wonder what could be the cause of such a fatal error when using g_hbond > with -contact option. > > The two index group I chose have no overlap, but certain index group pairs > worked while others did not and gave this fatal error. > > Thanks, > Yun > -- gmx-users mailing list gmx-users@gromacs.org 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 gmx-users-requ...@gromacs.org. * Can't post? Read http://www.gromacs.org/Support/Mailing_Lists
