[gmx-users] Inactivate position restraint

[Justin Lemkul]

On 3/31/13 8:16 AM, Shima Arasteh wrote:
> Hi,
> To inactivate a position restraint, is it enough to make the define command in mdp file to a comment?
> ;define= DPOSRES
>

Yes.  Or remove it altogether.

-Justin

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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

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