[gmx-users] calculate velocity autocorrelation function

[Mark Abraham]

Yes, per g_velacc -h ;-)

Mark


On Wed, Nov 27, 2013 at 2:54 PM, Mahboobeh Eslami <
mahboobeh.eslami at yahoo.com> wrote:

> dear justin
>
>
>
> Do I need a special option in the mdp file.
> thanks a lot
>
>
>
>
> On Wednesday, November 27, 2013 4:40 PM, Justin Lemkul <jalemkul at vt.edu>
> wrote:
>
>
>
>
> On 11/27/13 1:16 AM, Mahboobeh Eslami wrote:
> > hi Dear Gmx Users
> >
> > please help me
> >
> > i want to  calculate velocity autocorrelation function by gromacs but I
> do not know exactly what is needed. Please Help me, please
>
> g_velacc -h
>
> -Justin
>
> --
> ==================================================
>
> 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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