[gmx-users] Gromacs-5.1.2 Checkpoint/restart example

[Justin Lemkul]

On 4/24/16 12:04 AM, Husen R wrote:
> Dear all,
>
> is there any complete documentation discussing checkpoint/restart in
> Gromacs-5.1.2 ?
> I found this link that discuss checkpoint (
> http://www.gromacs.org/Documentation/How-tos/Extending_Simulations) and
> this link that discuss restart (
> http://www.gromacs.org/Documentation/How-tos/Doing_Restarts) but these are
> not specifically for gromacs 5.1.2.
>

There are no differences for 5.1.2, so that information is all relevant.

-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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