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AMBER Archive (2009)Subject: Re: [AMBER] Strange QM/MM Divcon - help me out
From: case (case_at_biomaps.rutgers.edu)
On Thu, Aug 13, 2009, s. Bill wrote:
> I was trying to do simulation of a solvated protein using QM/MM
Just a question: are you sure you want to do this? It looks like your
> atoms, and after 3ps it stopped, becuase a part of the protein moving
You probably need to run a simulation slightly shorter than the one that
...dac
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