AMBER: RDC refinement

From: Lee, Young-Tae <>
Date: Fri, 8 Dec 2006 14:50:42 -0600


I am carrying out minimization and rMD of NMR structures using Amber9. How can I set a force constant for RDC restraints?
Also how can I start rMD with alignment tensors from last alignment tensor set in the previous minimization? Or not much important to have such initial tensors?


The AMBER Mail Reflector
To post, send mail to
To unsubscribe, send "unsubscribe amber" to
Received on Sun Dec 10 2006 - 06:07:05 PST
Custom Search