calculate the binding energy or binding free energy?

From: ying xiong (yxiong_at_mail.ccnu.edu.cn)
Date: Thu Sep 02 2004 - 03:49:40 CDT

• Next message: Blake Charlebois: "RE: Calculation of velocities"
• Previous message: LEWYN LI: "Questions on periodic boundary condition"
• Next in thread: LEWYN LI: "Re: calculate the binding energy or binding free energy?"
• Reply: LEWYN LI: "Re: calculate the binding energy or binding free energy?"
• Messages sorted by: [ date ] [ thread ] [ subject ] [ author ] [ attachment ]

Dear sir,
   Could you please tell me whether NAMD program can calculate the bind energy or binding free energy of protein and ligand ? If yes, how to calculate it?
                                 

　　　　　　　　ying xiong
　　　　　　　　yxiong_at_mail.ccnu.edu.cn
　　　　　　　　　　2004-09-02

• Next message: Blake Charlebois: "RE: Calculation of velocities"
• Previous message: LEWYN LI: "Questions on periodic boundary condition"
• Next in thread: LEWYN LI: "Re: calculate the binding energy or binding free energy?"
• Reply: LEWYN LI: "Re: calculate the binding energy or binding free energy?"
• Messages sorted by: [ date ] [ thread ] [ subject ] [ author ] [ attachment ]

This archive was generated by hypermail 2.1.6 : Wed Feb 29 2012 - 15:37:50 CST