[gmx-users] global or local minimum

Justin A. Lemkul jalemkul at vt.edu
Sun Jan 24 13:25:51 CET 2010



shahab shariati wrote:
> /Hi
> //  
> //after energy minimization step, how can be understand that obtained 
> //structure is in global or local minimum?
> // 
> //
> /
> 

This identical question was posted just a few days ago and received an answer then:

http://lists.gromacs.org/pipermail/gmx-users/2010-January/047942.html

-Justin

-- 
========================================

Justin A. Lemkul
Ph.D. Candidate
ICTAS Doctoral Scholar
MILES-IGERT Trainee
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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