QM/MM computational studies of substrate water binding to the oxygen-evolving centre of photosystem II

Philosophical Transactions of the Royal Society B: Biological Sciences

Volumn 363, Issue 1494, 2008, Pages 1149-1156

  Sproviero, Eduardo M ^a   Shinopoulos, Katherine ^a   Gascón, José A ^a,b   McEvoy, James P ^a,c   Brudvig, Gary W ^a   Batista, Victor S ^a  

^a YALE UNIVERSITY   (United States)

^b UNIVERSITY OF CONNECTICUT   (United States)

^c REGIS UNIVERSITY   (United States)

Author keywords

Density functional theory; Oxomanganese complexes; Oxygen evolution; Photosynthesis; Photosystem II; Quantum mechanics molecular mechanics

Indexed keywords

AMINO ACID; CALCIUM; CHEMICAL BINDING; CHLORIDE; COMPUTATIONAL FLUID DYNAMICS; CYANOBACTERIUM; EXPERIMENTAL STUDY; HYDROXIDE; MANGANESE; OXIDATION; OXYGEN ISOTOPE; PHOTOSYNTHESIS; QUANTUM MECHANICS; WATER EXCHANGE;

THERMOSYNECHOCOCCUS ELONGATUS;

EID: 38949181942     PISSN: 09628436     EISSN: None     Source Type: Journal    
DOI: 10.1098/rstb.2007.2210     Document Type: Article

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