AMBER Archive (2008)

Subject: AMBER: Is there an easy way to calculate the electric field at the center of a group of atoms

From: Ye Mei (ymei_at_itcc.nju.edu.cn)
Date: Thu Nov 27 2008 - 09:12:51 CST

Dear Amber users,

Can anyone tell me that if there is an easy way to calculate the electric field at the center of a group of atoms
from the trajectory of molecular dynamics simulation with periodic boundary?
　　　　　　
                                 
Best regards,

Ye Mei
ymei_at_itcc.nju.edu.cn
Institute of Theoretical and Computational Chemistry
Key Laboratory of Mesoscopic Chemistry of MOE
School of Chemistry and Chemical Engineering
Nanjing University
Nanjing 210093
P.R.China
2008-11-27

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