AMBER Archive (2005)

Subject: AMBER: GB refinement of CYANA structures

From: Eugene DeRose (derose_at_niehs.nih.gov)
Date: Fri Sep 16 2005 - 08:25:52 CDT


Dear AMBER users,

I would like to refine CYANA structures using generalized Born solvent
refinement. Bin Xia, et al., JBNMR 22, 317-331, 2002, describe such a
procedure, but the experimental discussion does not give a detailed
account of the GB MD refinement protocol. Can anyone refer me to a
more detailed account of a GB MD protocol for refining NMR structures?

Best regards,
Eugene

-- 
Eugene DeRose, Ph.D.
NMR Laboratory Manager
National Institute of Environmental Health Sciences
ITSS Contractor
Phone: 919-541-1981 Fax: 919-541-5707

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