Re: [AMBER] Switch function in Amber

From: David A Case <>
Date: Thu, 10 Jul 2014 07:46:45 -0400

On Thu, Jul 10, 2014, Ramuntcho Moretti wrote:
> Is there a switching function applied on
> the electrostatic and VanDerWaals interactions in Amber?

There are no explicit switching functions. (The division of electrostatics
into direct and reciprocal parts involves an erf/erfc function that acts
something like a switch.)


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Received on Thu Jul 10 2014 - 05:00:02 PDT
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