[gmx-users] MARTINI MD-CG

Kieu Thu Nguyen kieuthu2212 at gmail.com
Wed Dec 19 00:15:27 CET 2012


Thank Justin !


On Tue, Dec 18, 2012 at 10:31 PM, Justin Lemkul <jalemkul at vt.edu> wrote:

>
>
> On 12/18/12 10:30 AM, Kieu Thu Nguyen wrote:
>
>> Dear All,
>>
>> Are there any difference in nvt.mdp and npt.mdp files between MD-CG and
>> MD-AA ?
>>
>>
> Settings in the .mdp file are dictated by the chosen force field.  Every
> force field is different and requires proper settings.
>
> -Justin
>
> --
> ==============================**==========
>
> Justin A. Lemkul, Ph.D.
> Research Scientist
> Department of Biochemistry
> Virginia Tech
> Blacksburg, VA
> jalemkul[at]vt.edu | (540) 231-9080
> http://www.bevanlab.biochem.**vt.edu/Pages/Personal/justin<http://www.bevanlab.biochem.vt.edu/Pages/Personal/justin>
>
> ==============================**==========
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