AMBER: calculating box dimensions during MD

From: Vlad Cojocaru <Vlad.Cojocaru.eml-r.villa-bosch.de>
Date: Tue, 06 Jun 2006 16:13:14 +0200

Dear Amber users,

Could somebody give me a hint how can I plot the evolution of box
dimensions during MD trajectories?

Also, maybe some of you know how can one monitor the TEMP in subparts of
the system....

Thanks in advance
Best wishes
vlad 

-- 
Dr. Vlad Cojocaru
EML Research gGmbH
Molecular and Cellular Modeling Group
Schloss-Wolfsbrunnenweg 33
69118 Heidelberg, Germany
Phone: +49-6221-533266
Fax: +49-6221-533298
e-mail: Vlad.Cojocaru.eml-r.villa-bosch.de
http://projects.villa-bosch.de/mcm/people/cojocaru/
-----------------------------------------------------------------------
The AMBER Mail Reflector
To post, send mail to amber.scripps.edu
To unsubscribe, send "unsubscribe amber" to majordomo.scripps.edu
Received on Wed Jun 07 2006 - 06:07:12 PDT
Custom Search