Re: [AMBER] How to find a protein's energy

From: Ashish Runthala <ashish.runthala.gmail.com>
Date: Sun, 6 Sep 2009 13:30:26 +0100

 if so, you can load your prmtop and inpcrd into sander, set imin=1 and
nstlim=0.
you will get the energy without minimization.

This is what i was asking about. But i was thinking something else too,
while i wrote this mail. Anyway thanx for the help sir. 


-- 
Ashish Runthala,
Faculty Division III,
Assistant Lecturer, Biological Sciences,
Birla Institute of Technology and Science,
Pilani, Rajasthan- 333031
INDIA
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Received on Mon Sep 14 2009 - 12:04:01 PDT
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