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