Re: [AMBER] How to keep Graphene sheet fixed during MD simulation.

From: David A Case <case.biomaps.rutgers.edu>
Date: Mon, 7 Nov 2011 09:08:58 -0500

On Mon, Nov 07, 2011, hai wei wrote:

> ”Third, 500 is too strong a force constant for most purposes. Consider
> using a value about two orders of magnitude smaller.“
>
> If I want to keep Graphene sheet Constrain in the MD simulaiton, is 500
> still too much?

Yes....dac

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Received on Mon Nov 07 2011 - 06:30:03 PST
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