Fw: [gmx-users] position restraints
Justin Lemkul
jalemkul at vt.edu
Tue Mar 26 19:35:39 CET 2013
On Tue, Mar 26, 2013 at 2:33 PM, Shima Arasteh
<shima_arasteh2001 at yahoo.com>wrote:
> Thanks for all your explanations.
> What I get as a conclusion is this:
> itp files are dependent to the numbering of aoms in molecule type
> directive and not any other things! Each posre.itp file created by genrestr
> should be in consistent with the molculetype numbering!
>
>
Yes, exactly.
-Justin
--
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Justin A. Lemkul, Ph.D.
Research Scientist
Department of Biochemistry
Virginia Tech
Blacksburg, VA
jalemkul[at]vt.edu | (540)
231-9080http://www.bevanlab.biochem.vt.edu/Pages/Personal/justin
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