Re: [AMBER] Problem with VDW energy

From: David A Case <david.case.rutgers.edu>
Date: Fri, 2 Oct 2015 14:30:42 -0400

On Fri, Oct 02, 2015, Brent Krueger wrote:
>
> We are modeling salt crystals and have done extensive
> convergence testing for all of the simulations we are running.

What is the value of "cut" in your input files? (Ross' suggestion is also a
good one, to help narrow down possible causes.)

...dac


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Received on Fri Oct 02 2015 - 12:00:03 PDT
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