Re: [gmx-users] regarding charge group

2013-10-22 Thread Mark Abraham
Probably, make your broken molecules whole before passing them to grompp. Mark On Tue, Oct 22, 2013 at 8:26 AM, Sathish Kumar wrote: > The sum of the two largest charge group radii (13.336) is larger > than rlist(1.2) - rvdw/rcoulomb i am getting this error while running > membrane simulations.

[gmx-users] regarding charge group

2013-10-21 Thread Sathish Kumar
The sum of the two largest charge group radii (13.336) is larger than rlist(1.2) - rvdw/rcoulomb i am getting this error while running membrane simulations. please any one suggest how to rectify this error. -- regards M.SathishKumar -- gmx-users mailing listgmx-users@gromacs.org http://lists.