[gmx-users] NPT equilibration in KALP15-DPPC

Justin Lemkul jalemkul at vt.edu
Tue Aug 28 18:34:01 CEST 2012



On 8/28/12 12:33 PM, Shima Arasteh wrote:
>
>
> OK, but what about the index file after removing water molecules, updating .gro and .top file? Should it be generated again?
>

Yes.

-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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