From: Chris Harrison (charris5_at_gmail.com)
Date: Wed Mar 28 2012 - 15:41:39 CDT
Sure, no problem. Just let me know as we'd want to fix any bugs that might
exist in the source.
On Wed, Mar 28, 2012 at 3:58 AM, Francesco Pietra <
> on checking the work being done, it turned out that the center of mass
> of the ligand was a bit incorrect. I am now checking if this was the
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