can you be more specific? do you want sander to modify the relative orientation of
the groups, or just calculate the values? do you want to change their distance, angle,
rmsd, etc? please let us know what you want to do and we might be able to help more.
carlos
----- Original Message -----
From: Helios Chen
To: amber.scripps.edu
Sent: Sunday, March 28, 2004 10:07 PM
Subject: AMBER: fix two groups
Dear amber users, I want to fix two segments on the one protein, and calculate the relative changes each other by sander MD program. Are there any restriction I can fix these two groups?
Best Regards.
-----------------------------------------------------------------------
The AMBER Mail Reflector
To post, send mail to amber.scripps.edu
To unsubscribe, send "unsubscribe amber" to majordomo.scripps.edu
Received on Mon Mar 29 2004 - 04:53:01 PST