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Design of Radical-Resistant Amino Acid Residues: A Combined Theoretical and Experimental Investigation

Croft, Anna; Easton, Christopher; Radom, Leo

Description

Ab initio calculations have been used to design radical -resistant amino acid residues. Optimized structures of free and protected amino acids and their corresponding β-carbon-centered radicals were determined with B3-LYP/6-31G(d). Single-point RMP2/6-31

CollectionsANU Research Publications
Date published: 2003
Type: Journal article
URI: http://hdl.handle.net/1885/88366
Source: Journal of the American Chemical Society
DOI: 10.1021/ja029674v

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