AMBER Archive (2009)
Subject: Re: [AMBER] RDC and alignment tensor
From: Eliana Asciutto (ekasciut_at_gmail.com)
Date: Fri Oct 23 2009 - 14:19:00 CDT
I finally found the problem.
In the experimental samples Cys are replaced by Ala. Although I didn't
notice that, sander did giving NaN values. When I removed the restraint
associated with the Cys everything worked fine.
Thanks for all the help,
AMBER mailing list