AMBER Archive (2008)

Subject: Re: AMBER: Ewald error estimate

From: David A. Case (case_at_scripps.edu)
Date: Thu May 08 2008 - 12:16:43 CDT

On Thu, May 08, 2008, ???????? wrote:
>
>
> I guess maybe the problem caused by high VDW, but not sure.

Just to be as clear as we can be: the "high VDW" values you are seeing are
*not* a "problem". They are what you should expect. See Prof. Cheatham's post
for more details here.

...dac

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