AMBER: NEB tutorial

From: deepti nayar <deepti.icgeb.gmail.com>
Date: Mon, 12 Mar 2007 15:33:17 +0530

hi amber users

I am doing amber advanced workshop tutorial 5- The Nudged Elastic Band
Approach to Finding the Lowest Energy Pathway Between two States . I
wanted to know how to generate the two end point structures which
differ in their ? suppose If i want to make those 30 structures and i
want to make them with different torsion angles, then how can i change
their torsion angle?
any sugguestions are welcome.


thanx
-----------------------------------------------------------------------
The AMBER Mail Reflector
To post, send mail to amber.scripps.edu
To unsubscribe, send "unsubscribe amber" to majordomo.scripps.edu
Received on Wed Mar 14 2007 - 06:07:13 PDT
Custom Search