期刊
CURRENT OPINION IN CHEMICAL BIOLOGY
卷 5, 期 6, 页码 736-743出版社
CURRENT BIOLOGY LTD
DOI: 10.1016/S1367-5931(01)00273-3
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Recent progress in computational modeling of the catalytic activation of cobalt-carbon bond cleavage shows that quantum chemical calculations could be an important part of coenzyme B-12 research. Particular emphasis has been placed on density functional theory, which is now emerging as a powerful too[ to elucidate the electronic structure and spectroscopic properties of the active sites of metalloenzymes.
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