Re: [AMBER] Query on Minimization

From: Bill Ross <>
Date: Fri, 5 Mar 2010 09:26:28 -0800 (PST)

> At the minimization time how i can know that protein has reached to its
> convergence .

It usually doesn't matter - all you need is to relax things a
little to set things up for dynamics. Note that low-temp
dynamics will usually lower energy more than minimization.


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Received on Fri Mar 05 2010 - 09:30:03 PST
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