From: Mark M Huntress (markmh_at_bgsu.edu)
Date: Fri Sep 03 2010 - 09:53:38 CDT
Hi, I was wondering if it is unusual, or indicative of a problem, if the solute molecule of interest moves to the edges, in fact, across the edges, of an 8 Å methanol solvent box with periodic boundary conditions.
Thanks.
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