[gmx-users] How to Run Energy Minimisation
Justin A. Lemkul
jalemkul at vt.edu
Thu Jul 30 01:49:40 CEST 2009
Nancy wrote:
> Hello,
>
> I am trying to run energy minimisation on a lipid bilayer (downloaded
> from: http://moose.bio.ucalgary.ca/files/dppc128.pdb). I inflated the
> bilayer using "InflateGRO" however, when I try to run the minimisation,
> it seems to display the un-inflated bilayer. Please advise.
>
Without seeing the command lines that you're issuing, we can only assume you are
doing something wrong.
-Justin
> Thank you.
>
> Nancy
>
>
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--
========================================
Justin A. Lemkul
Ph.D. Candidate
ICTAS Doctoral Scholar
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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