[gmx-users] Martini and Gromacs 3 and 4

[Justin Lemkul]

On Fri, Nov 22, 2013 at 2:16 PM, Steve Seibold <stevesei at ymail.com> wrote:

> Hello
> I was under the impression that I needed Gromacs 3.3.1 to implement the
> Martini FF. But as I have been looking at mdp files for Martini, I am
> finding statements about this mdp file to be used for Gromacs 4. I must be
> missunderstanding something here...Can I use Gromacs 4.5.4 to run Martini
> FF?
>
>
Sure. The only relevant changes in Gromacs there are in the way the force
fields are organized, but MARTINI can certainly work in the newest Gromacs
versions (even newer than 4.5.4).

-Justin

-- 

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Justin A. Lemkul, Ph.D.
Postdoctoral Fellow

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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