AMBER Archive (2008)

Subject: AMBER: ESP on atoms (2)

From: Khatcharin Siriwong (skhatcha_at_kku.ac.th)
Date: Wed Apr 23 2008 - 09:29:04 CDT

Deal All,

It there a way that sander prints out the ESP on all or specified atoms of each snapshot during running MD simulation with periodic boundary condition? Post-process is prefered (I already got trajectory).

Many thanks,

Khatcharin

 

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