[AMBER] Is there a shift of QM energy in a QM/MM simulation?

From: Pengfei Li <lipengfei_mail.126.com>
Date: Fri, 18 Mar 2016 20:26:47 +0800 (CST)

Dear all,

In a QM/MM simulation with AMBER, whether there is a shift of QM energy or not?
If it exists, how does AMBER give the shift value?


Best,
Pengfei Li

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Pengfei Li
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Received on Fri Mar 18 2016 - 05:30:05 PDT