[gmx-users] Scripts to the gromacs

[Justin Lemkul]

On 1/4/16 6:09 PM, Elsaid Younes wrote:
> Hey all,
>
> I wish I can find a way to help me writing a script to the gromacs. I mean
> by scripts "the commands that one writes to gramacs terminals and the
> choices, which are prompted after command's processing, all collected in
> one file"
> I do simulation like lysozyme in water tutorial.
> Looking forward to hearing from you!
>

http://www.gromacs.org/Documentation/How-tos/Using_Commands_in_Scripts

-Justin

-- 
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Justin A. Lemkul, Ph.D.
Ruth L. Kirschstein NRSA Postdoctoral Fellow

Department of Pharmaceutical Sciences
School of Pharmacy
Health Sciences Facility II, Room 629
University of Maryland, Baltimore
20 Penn St.
Baltimore, MD 21201

jalemkul at outerbanks.umaryland.edu | (410) 706-7441
http://mackerell.umaryland.edu/~jalemkul

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