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Alexandre Barrozo - Publications

Affiliations: 
2011-2016 Cell and Molecular Biology Uppsala University, Uppsala, Uppsala län, Sweden 
 2016-2018 Chemistry University of Southern California, Los Angeles, CA, United States 
 2019- Aix-Marseille Université 
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17 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
2020 Pieri C, Bhattacharjee A, Barrozo A, Faure B, Giorgi M, Fize J, Réglier M, Field M, Orio M, Artero V, Hardré R. Hydrogen evolution reaction mediated by an all-sulfur trinuclear nickel complex. Chemical Communications (Cambridge, England). PMID 32812950 DOI: 10.1039/D0Cc04174B  0.317
2019 Barrozo A, Orio M. Molecular electrocatalysts for Hydrogen Evolution Reaction: The input from quantum chemistry. Chemsuschem. PMID 31557393 DOI: 10.1002/Cssc.201901828  0.388
2019 Barrozo A, Xu B, Gunina AO, Jacobs MI, Wilson KR, Kostko O, Ahmed M, Krylov AI. To Be or Not to Be a Molecular Ion: The Role of Solvent in Photoionization of Arginine. The Journal of Physical Chemistry Letters. PMID 30933520 DOI: 10.1021/Acs.Jpclett.9B00494  0.721
2019 Baier F, Hong N, Yang G, Pabis A, Miton CM, Barrozo A, Carr PD, Kamerlin SC, Jackson CJ, Tokuriki N. Cryptic genetic variation shapes the adaptive evolutionary potential of enzymes. Elife. 8. PMID 30719972 DOI: 10.7554/Elife.40789  0.745
2019 Wang L, Gennari M, Barrozo A, Fize J, Philouze C, Demeshko S, Meyer F, Orio M, Artero V, Duboc C. Role of the Metal Ion in Bio-Inspired Hydrogenase Models: Investigation of a Homodinuclear FeFe Complex vs Its Heterodinuclear NiFe Analogue Acs Catalysis. 10: 177-186. DOI: 10.1021/Acscatal.9B03212  0.323
2018 Xu S, Barrozo A, Tender LM, Krylov AI, El-Naggar MY. Multiheme Cytochrome Mediated Redox Conduction Through Shewanella oneidensis MR-1 Cells. Journal of the American Chemical Society. PMID 30056703 DOI: 10.1021/Jacs.8B05104  0.496
2018 Barrozo A, El-Naggar MY, Krylov A. Distinct Electron Conductance Regimes in Bacterial Decaheme Cytochromes. Angewandte Chemie (International Ed. in English). PMID 29663609 DOI: 10.1002/Anie.201800294  0.511
2018 Barrozo A, Liao Q, Esguerra M, Marloie G, Florián J, Williams NH, Kamerlin SCL. Computer simulations of the catalytic mechanism of wild-type and mutant β-phosphoglucomutase. Organic & Biomolecular Chemistry. PMID 29508879 DOI: 10.1039/C8Ob00312B  0.701
2018 Baier F, Hong N, Yang G, Pabis A, Miton CM, Barrozo A, Carr PD, Kamerlin SC, Jackson CJ, Tokuriki N. Author response: Cryptic genetic variation shapes the adaptive evolutionary potential of enzymes Elife. DOI: 10.7554/Elife.40789.031  0.714
2018 Bauer P, Barrozo A, Amrein BA, Purg M, Esguerra M, Wilson PB, Major DT, Aqvist J, Kamerlin SCL. Q6: A comprehensive toolkit for empirical valence bond and related free energy calculations Softwarex. DOI: 10.1016/J.Softx.2017.12.001  0.643
2017 Barrozo A, Blaha-Nelson D, Williams NH, Kamerlin SCL. The effect of magnesium ions on triphosphate hydrolysis Pure and Applied Chemistry. 89: 715-727. DOI: 10.1515/Pac-2016-1125  0.4
2016 Duarte F, Barrozo A, Aqvist J, Williams NH, Kamerlin SC. The Competing Mechanisms of Phosphate Monoester Dianion Hydrolysis. Journal of the American Chemical Society. PMID 27471914 DOI: 10.1021/Jacs.6B06277  0.736
2015 Barrozo A, Duarte F, Bauer P, Carvalho AT, Kamerlin SC. Cooperative Electrostatic Interactions Drive Functional Evolution in the Alkaline Phosphatase Superfamily. Journal of the American Chemical Society. PMID 26091851 DOI: 10.1021/Jacs.5B03945  0.76
2015 Shurki A, Derat E, Barrozo A, Kamerlin SC. How valence bond theory can help you understand your (bio)chemical reaction. Chemical Society Reviews. 44: 1037-52. PMID 25352378 DOI: 10.1039/C4Cs00241E  0.639
2014 Carvalho AT, Barrozo A, Doron D, Kilshtain AV, Major DT, Kamerlin SC. Challenges in computational studies of enzyme structure, function and dynamics. Journal of Molecular Graphics & Modelling. 54: 62-79. PMID 25306098 DOI: 10.1016/J.Jmgm.2014.09.003  0.747
2014 Duarte F, Bauer P, Barrozo A, Amrein BA, Purg M, Aqvist J, Kamerlin SC. Force field independent metal parameters using a nonbonded dummy model. The Journal of Physical Chemistry. B. 118: 4351-62. PMID 24670003 DOI: 10.1021/Jp501737X  0.662
2012 Barrozo A, Borstnar R, Marloie G, Kamerlin SC. Computational protein engineering: bridging the gap between rational design and laboratory evolution. International Journal of Molecular Sciences. 13: 12428-60. PMID 23202907 DOI: 10.3390/Ijms131012428  0.726
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