Eduardo M. Sproviero - Publications

Affiliations: 
Yale University, University of the Sciences 
Area:
Computational Chemistry, Theoretical Chemistry, Bioinorganic Chemistry

16 high-probability publications. We are testing a new system for linking publications to authors. You can help! If you notice any inaccuracies, please sign in and mark papers as correct or incorrect matches. If you identify any major omissions or other inaccuracies in the publication list, please let us know.

Year Citation  Score
2013 Li X, Sproviero EM, Ryde U, Batista VS, Chen G. Theoretical EXAFS studies of a model of the oxygen-evolving complex of photosystem II obtained with the quantum cluster approach International Journal of Quantum Chemistry. 113: 474-478. DOI: 10.1002/Qua.24143  0.583
2010 Li G, Sproviero EM, McNamara WR, Snoeberger RC, Crabtree RH, Brudvig GW, Batista VS. Reversible visible-light photooxidation of an oxomanganese water-oxidation catalyst covalently anchored to TiO2 nanoparticles. The Journal of Physical Chemistry. B. 114: 14214-22. PMID 19924873 DOI: 10.1021/Jp908925Z  0.757
2009 Sproviero EM, Newcomer MB, Gascón JA, Batista ER, Brudvig GW, Batista VS. The MoD-QM/MM methodology for structural refinement of photosystem II and other biological macromolecules. Photosynthesis Research. 102: 455-70. PMID 19633920 DOI: 10.1007/S11120-009-9467-6  0.654
2009 Li G, Sproviero EM, Snoeberger RC, Iguchi N, Blakemore JD, Crabtree RH, Brudvig GW, Batista VS. Deposition of an oxomanganese water oxidation catalyst on TiO2 nanoparticles: Computational modeling, assembly and characterization Energy and Environmental Science. 2: 230-238. DOI: 10.1039/B818708H  0.753
2008 Sproviero EM, Gascón JA, McEvoy JP, Brudvig GW, Batista VS. Computational studies of the O(2)-evolving complex of photosystem II and biomimetic oxomanganese complexes. Coordination Chemistry Reviews. 252: 395-415. PMID 19190716 DOI: 10.1016/J.Ccr.2007.09.006  0.77
2008 Sproviero EM, McEvoy JP, Gascón JA, Brudvig GW, Batista VS. Computational insights into the O2-evolving complex of photosystem II. Photosynthesis Research. 97: 91-114. PMID 18483777 DOI: 10.1007/S11120-008-9307-0  0.764
2008 Sproviero EM, Gascón JA, McEvoy JP, Brudvig GW, Batista VS. A model of the oxygen-evolving center of photosystem II predicted by structural refinement based on EXAFS simulations. Journal of the American Chemical Society. 130: 6728-30. PMID 18457397 DOI: 10.1021/Ja801979N  0.738
2008 Sproviero EM, Gascón JA, McEvoy JP, Brudvig GW, Batista VS. Quantum mechanics/molecular mechanics study of the catalytic cycle of water splitting in photosystem II. Journal of the American Chemical Society. 130: 3428-42. PMID 18290643 DOI: 10.1021/Ja076130Q  0.745
2008 Sproviero EM, Shinopoulos K, Gascón JA, McEvoy JP, Brudvig GW, Batista VS. QM/MM computational studies of substrate water binding to the oxygen-evolving centre of photosystem II. Philosophical Transactions of the Royal Society of London. Series B, Biological Sciences. 363: 1149-56; discussion . PMID 17971333 DOI: 10.1098/Rstb.2007.2210  0.73
2008 Iguchi N, Cady C, Snoeberger RC, Hunter BM, Sproviero EM, Schmuttenmaer CA, Crabtree RH, Brudvig GW, Batista VS. Characterization of siloxane adsorbates covalently attached to TiO 2 Proceedings of Spie - the International Society For Optical Engineering. 7034. DOI: 10.1117/12.798938  0.716
2007 Sproviero EM, Gascón JA, McEvoy JP, Brudvig GW, Batista VS. Quantum mechanics/molecular mechanics structural models of the oxygen-evolving complex of photosystem II. Current Opinion in Structural Biology. 17: 173-80. PMID 17395452 DOI: 10.1016/J.Sbi.2007.03.015  0.754
2006 Sproviero EM, Gascón JA, McEvoy JP, Brudvig GW, Batista VS. QM/MM Models of the O2-Evolving Complex of Photosystem II. Journal of Chemical Theory and Computation. 2: 1119-34. PMID 26633071 DOI: 10.1021/Ct060018L  0.742
2006 Gascón JA, Sproviero EM, Batista VS. Computational studies of the primary phototransduction event in visual rhodopsin. Accounts of Chemical Research. 39: 184-93. PMID 16548507 DOI: 10.1021/Ar050027T  0.665
2006 Leung K, Rempe SB, Schultz PA, Sproviero EM, Batista VS, Chandross ME, Medforth CJ. Density functional theory and DFT+U study of transition metal porphines adsorbed on Au(111) surfaces and effects of applied electric fields. Journal of the American Chemical Society. 128: 3659-68. PMID 16536538 DOI: 10.1021/Ja056630O  0.537
2006 Sproviero EM, Gascon JA, McEvoy JP, Brudvig GW, Batista VS. Characterization of synthetic oxomanganese complexes and the inorganic core of the O2-evolving complex in photosystem II: evaluation of the DFT/B3LYP level of theory. Journal of Inorganic Biochemistry. 100: 786-800. PMID 16510187 DOI: 10.1016/J.Jinorgbio.2006.01.017  0.708
2005 Gascón JA, Sproviero EM, Batista VS. QM/MM Study of the NMR Spectroscopy of the Retinyl Chromophore in Visual Rhodopsin. Journal of Chemical Theory and Computation. 1: 674-85. PMID 26641690 DOI: 10.1021/Ct0500850  0.657
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