AMBER Archive (2007)

Subject: AMBER: 来自pig5678的邮件

From: pig5678 (pig5678_at_163.com)
Date: Tue Jul 10 2007 - 01:59:22 CDT

 Dear David
 I am using the thermodynamic integration method to calculate free energy, but I do not know how to turn off the van der waals interaction, and I do not how to introduce the "dummy" atoms.I would be most happy if you can tell me, I am looking forward to hearing from you. thank you very much.
                                                                                                 liliduan

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