AMBER Archive (2009)

Subject: [AMBER] How to consider the off centre charges

From: Ashish Runthala (
Date: Wed Sep 02 2009 - 10:28:40 CDT

Hello AMBER users
Tell me the differences in the solvent minimization (both implicitly
and explicitly) script for best obtaining the results if i consider
off centre charges with TIP4P or TIP5P.


Ashish Runthala,
Faculty Division III,
Assistant Lecturer, Biological Sciences,
Birla Institute of Technology and Science,
Pilani, Rajasthan- 333031

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