From: wenhao_at_uchicago.edu
Date: Fri Sep 09 2011 - 03:21:01 CDT
Hi,
I see that FEP can only be implemented with PME, and because PME need the PBC, so we can not run FEP in water sphere, yes?
And is there any possibility that we can turn off PME in FEP calculation to avoid the image effect?
Thanks a lot.
Wenhao
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