[gmx-users] cut-off for different groups GROMACS 4.6.3

[Justin Lemkul]

On Wed, Nov 20, 2013 at 10:47 AM, Jheng Wei Li <lijhengwei at gmail.com> wrote:

> Hello, all
> Could anyone help me on this?
> Could I choose different cut-offs for different groups?
> Like if I has atom A and B, Could I define 3 cut-off values for
> A-A, A-B and B-A respectively?
>
>
Mark already answered this:

https://mailman-1.sys.kth.se/pipermail/gromacs.org_gmx-users/2013-November/085569.html

-Justin

Thanks for any tips.
> JhengWei Li
>
>
> On Mon, Nov 18, 2013 at 6:50 PM, Jheng Wei Li <lijhengwei at gmail.com>
> wrote:
>
> > Hello, all
> > Could I choose different cut-offs for different groups?
> > Like if I has atom A and B, Could I define 3 cut-off values for
> > A-A, A-B and B-A respectively?
> >
> > Thanks for any tips.
> > JhengWei Li
> >
> --
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-- 

==========================================

Justin A. Lemkul, Ph.D.
Postdoctoral Associate

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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