AMBER Archive (2004)

Subject: AMBER: translational and rotational entropy

From: hj zou (hjzou_at_iris3.simm.ac.cn)
Date: Fri Nov 05 2004 - 00:48:22 CST


Dear amber users£¬
      Can anyone tell me the theory , principle or the formula to calculate the translational and rotational entropy in AMBER?
    Thank you in advance.
        

   Best regard,

***********************************************
Hanjun Zou
555 Zu Chong Zhi Road, Zhangjiang Hi-Tech Park
Drug Discovery and Design Center
Shanghai Institute of Meteria Medica
Chinese Academy of Sciences
Shanghai 201203, China
Tel£º +86-21-50806600-1201
E-mail: hjzou_at_mail.shcnc.ac.cn
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