Re: [AMBER] periodic boundary condition

From: Bill Ross <>
Date: Thu, 15 Apr 2010 11:12:03 -0700 (PDT)

> > Does minimization use PME?
> If not, then my suggestion certainly won't work :). I thought it did
> though, and that of course is based on no code-searching, but also a
> scan of the manual turned up no warnings that it did not work...

My impression is that pre-PME, minimization did not use the periodic
boundaries. If that's true, not sure whether PME was enabled for min.

> Perhaps someone that knows for sure can chime in.


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Received on Thu Apr 15 2010 - 11:30:03 PDT
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