[gmx-users] Get some specific frames of traj

[Justin Lemkul]

On 7/9/13 7:14 AM, Shima Arasteh wrote:
> I tried the tpr file for -s, but doesn't make difference.
>
>
> g_select -s npt_6.gro -f md_0_1.trr -select 'resname SOL and within 0.01
> of (3.6, 3.6, 6.3)' -seltype res_com -selrpos res_com -os
>
> Would you please give me suggestions? I found some resemble commands in mailing list but didn't find the problem with my command.
>

Use brackets instead of parenthesis.  I think there is a typo in the help 
information that was recently fixed.

-Justin

-- 
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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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