AMBER: How can I set ntx=7, but exclude the velocity?

From: Margaret S. Cheung <mscheung.ipst.umd.edu>
Date: Tue, 23 Sep 2003 11:30:28 -0400 (EDT)

Dear Amber user and developers.

I'd like to use periodic boundary condition (ntx=7) by sander_classic,
but I want to discard the velocity in that inpcrd file which contains
the size of the box. Thank you very much.

-- 
Sincerely,
----------------------------------------------------------------
Margaret S. Cheung,  Ph. D.    |  IPST UMCP Tel: (301)405-7568
Postdoctoral Fellow            |  IPST UMCP Fax: (301)314-9404
IPST  Room 2116                |  NCBI NIH  
University of Maryland         |  http://glue.umd.edu/~mscheung
College Park, MD 20742-2431    |  email: mscheung.ipst.umd.edu
----------------------------------------------------------------
-----------------------------------------------------------------------
The AMBER Mail Reflector
To post, send mail to amber.scripps.edu
To unsubscribe, send "unsubscribe amber" to majordomo.scripps.edu
Received on Tue Sep 23 2003 - 16:53:00 PDT
Custom Search