[AMBER] About ANAL problem: Amber

From: ΰ <ww5945.163.com>
Date: Wed, 21 Mar 2012 19:16:23 +0800 (CST)

Dear Amber user Ctrl+Xs:


I have been using AMBER9 on RED HAT Linux. Recently,I want to perform the ANAL module of Amber9 to assess the contributions of different structural moieties of the inhibitor to the interaction energy of the inhibitor with the protein. But in the ANAL input file,I can not correctly define the group format of the inhibitor. so here I want to know how I will write it. Thanks
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Received on Wed Mar 21 2012 - 04:30:03 PDT
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