[gmx-users] Index error
jalemkul at vt.edu
Thu Jul 25 22:38:16 CEST 2013
Please don't reply to the whole digest.
On 7/25/13 1:47 PM, Collins Nganou wrote:
> Dear Justin,
> Thanks for your answer...
> I move so far...
> My aim was to ask gromacs to read directly a modify protein SOL+NA, not
> protein SOL NA
> But I have not succeed so far.
I don't understand what you're asking here, and without exact commands, output,
.mdp settings, etc there's little anyone can do to assist you. Again, the task
that you need to carry out is described explicitly in most tutorials so please
do make an effort to follow existing protocols.
Justin A. Lemkul, Ph.D.
Department of Pharmaceutical Sciences
School of Pharmacy
Health Sciences Facility II, Room 601
University of Maryland, Baltimore
20 Penn St.
Baltimore, MD 21201
jalemkul at outerbanks.umaryland.edu | (410) 706-7441
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