[gmx-users] Restrict Terminal of protein?

Tsjerk Wassenaar tsjerkw at gmail.com
Wed Mar 21 11:38:54 CET 2007

Hi Qiang Zhong,

You can use position_restraints or define distance_restraints (Chapter
5). But will you get meaningful results?



On 3/21/07, Qiang Zhong <zqiang320 at webmail.hzau.edu.cn> wrote:
> Dear user:
>      I am do a complex simulation,recepter is big protein,So I  cut a domain of
> it to simulation, when I simulation, the terminal of receptor(cut) disordered,
> So I want to restrict it,just fix it on a point,
>      Could somebody tell me how to do?
>      Thank you very much!
> ------------------------------
> Qiang Zhong
> Key Lab of Agricultural Animal Genetics, Breeding and Reproduction of Ministry of Education
> College of Animal Sciences and Technology
> Huazhong Agricultural University
> Wuhan,Hubei, 430070
> PR China
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Tsjerk A. Wassenaar, Ph.D.
Junior UD (post-doc)
Biomolecular NMR, Bijvoet Center
Utrecht University
Padualaan 8
3584 CH Utrecht
The Netherlands
P: +31-30-2539931
F: +31-30-2537623

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