Artur Nenov;Silvio a Beccara;Ivan Rivalta;Giulio Cerullo;Shaul Mukamel;Marco Garavelli, Tracking Conformational Dynamics of Polypeptides by Nonlinear Electronic Spectroscopy of Aromatic Residues: A First-Principles Simulation Study, «CHEMPHYSCHEM», 2014, 15, pp. 3282 - 3290 [articolo]
Blakemore, James D.; Mara, Michael W.; Kushner-Lenhoff, Maxwell N.; Schley, Nathan D.; Konezny, Steven J.; Rivalta, Ivan; Negre, Christian F. A.; Snoeberger, Robert C.; Kokhan, Oleksandr; Huang, Jier; Stickrath, Andrew; Tran, Lan Anh; Parr, Maria L.; Chen, Lin X.; Tiede, David M.; Batista, Victor S.; Crabtree, Robert H.; Brudvig, Gary W., Characterization of an amorphous iridium water-oxidation catalyst electrodeposited from organometallic precursors, «INORGANIC CHEMISTRY», 2013, 52, pp. 1860 - 1871 [articolo]
Ivan Rivalta;Gary W. Brudvig;Victor S. Batista, Computational Studies of the Oxygen-Evolving Complex of Photosystem II and Biomimetic Oxomanganese Complexes for Renewable Energy ApplicationsApplications of Molecular Modeling to Challenges in Clean Energy, in: ACS Symposium SeriesApplications of Molecular Modeling to Challenges in Clean Energy, Washington, DC, American Chemical Society, 2013, pp. 203 - 215 [capitolo di libro]
Amin, Muhamed; Vogt, Leslie; Vassiliev, Serguei; Rivalta, Ivan; Sultan, Mohammad M.; Bruce, Doug; Brudvig, Gary W.; Batista, Victor S.*; Gunner, M.R., Electrostatic effects on proton coupled electron transfer in oxomanganese complexes inspired by the oxygen-evolving complex of photosystem II, «JOURNAL OF PHYSICAL CHEMISTRY. B, CONDENSED MATTER, MATERIALS, SURFACES, INTERFACES & BIOPHYSICAL», 2013, 117, pp. 6217 - 6226 [articolo]
Manley, Gregory; Rivalta, Ivan; Loria, J. Patrick, Solution NMR and computational methods for understanding protein allostery, «JOURNAL OF PHYSICAL CHEMISTRY. B, CONDENSED MATTER, MATERIALS, SURFACES, INTERFACES & BIOPHYSICAL», 2013, 117, pp. 3063 - 3073 [articolo]
Sekharan, Sivakumar*; Mooney, Victoria L.; Rivalta, Ivan; Kazmi, Manija A.; Neitz, Maureen; Neitz, Jay; Sakmar, Thomas P.; Yan, Elsa C. Y.; Batista, Victor S., Spectral tuning of ultraviolet cone pigments: An interhelical lock mechanism, «JOURNAL OF THE AMERICAN CHEMICAL SOCIETY», 2013, 135, pp. 19064 - 19067 [articolo]
Rivalta, Ivan*; Sultan, Mohammad M.; Lee, Ning-Shiuan; Manley, Gregory A.; Loria, J. Patrick; Batista, Victor S., Allosteric pathways in imidazole glycerol phosphate synthase, «PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA», 2012, 109, pp. E1428 - E1436 [articolo]
Rivalta, Ivan; Brudvig, Gary W; Batista, Victor S*, Oxomanganese complexes for natural and artificial photosynthesis, «CURRENT OPINION IN CHEMICAL BIOLOGY», 2012, 16, pp. 11 - 18 [articolo]
Luo, Sijie; Rivalta, Ivan; Batista, Victor; Truhlar, Donald G.*, Noncollinear spins provide a self-consistent treatment of the low-spin state of a biomimetic oxomanganese synthetic trimer inspired by the oxygen evolving complex of photosystem II, «THE JOURNAL OF PHYSICAL CHEMISTRY LETTERS», 2011, 2, pp. 2629 - 2633 [articolo]
Watt, Eric D.; Rivalta, Ivan; Whittier, Sean K.; Batista, Victor S.; Loria, J. Patrick, Reengineering rate-limiting, millisecond enzyme motions by introduction of an unnatural amino acid, «BIOPHYSICAL JOURNAL», 2011, 101, pp. 411 - 420 [articolo]
Rivalta, Ivan*; Amin, Muhamed; Luber, Sandra; Vassiliev, Serguei; Pokhrel, Ravi; Umena, Yasufumi; Kawakami, Keisuke; Shen, Jian-Ren; Kamiya, Nobuo; Bruce, Doug; Brudvig, Gary W.; Gunner, M.R.; Batista, Victor S., Structural-functional role of chloride in photosystem II, «BIOCHEMISTRY», 2011, 50, pp. 6312 - 6315 [articolo]
Luber, Sandra*; Rivalta, Ivan; Umena, Yasufumi; Kawakami, Keisuke; Shen, Jian-Ren; Kamiya, Nobuo; Brudvig, Gary W.; Batista, Victor S., S1-state model of the O2-evolving complex of photosystem II, «BIOCHEMISTRY», 2011, 50, pp. 6308 - 6311 [articolo]
Rivalta, Ivan; Mazzone, Gloria; Russo, Nino; Sicilia, Emilia*, The influence of surface oxygen and hydroxyl groups on the dehydrogenation of ethylene on PdAu surface alloys. A theoretical cluster model study, «CHEMICAL PHYSICS LETTERS», 2010, 493, pp. 87 - 93 [articolo]
RIVALTA, IVAN; Mazzone, Gloria; Russo, Nino; Sicilia, Emilia*, Adsorption of ethylene, vinyl, acetic acid, and acetate species on PdAu(111) and PdAu(100) surface alloys: A cluster model study, «JOURNAL OF CHEMICAL THEORY AND COMPUTATION», 2009, 5, pp. 1350 - 1360 [articolo]
Gotsis, H.J.; Rivalta, I.; Sicilia, E.; Russo, N.*, Atomic configurations of Pd atoms in PdAu(1 1 1) and PdAu(1 0 0) surface alloys: Ab initio density functional calculations, «CHEMICAL PHYSICS LETTERS», 2009, 468, pp. 162 - 165 [articolo]
