From: Michael Grabe (mgrabe_at_itsa.ucsf.edu)
Date: Thu Oct 27 2005 - 22:39:35 CDT
wei,
i don't know whether urestraint will work with
minimization. i use it during MD runs.
can anyone else tell us if urestraint works
during minimization?
if it does not, wei, you may consider fixing
the backbone atoms during your minimization.
-michael
------------------------------------------------------------------------
--------------------------
Michael Grabe, Ph.D.
Post-doctoral Fellow
Howard Hughes Medical Institute
University of California, San Francisco
1550 4th Street GD482
San Francisco, CA 94143
mgrabe_at_itsa.ucsf.edu
tel: ++ 415.476.4021
http://itsa.ucsf.edu/~mgrabe
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