Modern quantum chemistry with [Open] Molcas F Aquilante, J Autschbach, A Baiardi, S Battaglia, VA Borin, LF Chibotaru, ... The Journal of chemical physics 152 (21), 2020 | 335 | 2020 |
Retinal isomerization in bacteriorhodopsin captured by a femtosecond x-ray laser P Nogly, T Weinert, D James, S Carbajo, D Ozerov, A Furrer, D Gashi, ... Science 361 (6398), eaat0094, 2018 | 328 | 2018 |
Ir(III)-PC(sp3)P Bifunctional Catalysts for Production of H2 by Dehydrogenation of Formic Acid: Experimental and Theoretical Study S Cohen, V Borin, I Schapiro, S Musa, S De-Botton, NV Belkova, ... ACS Catalysis 7 (12), 8139-8146, 2017 | 55 | 2017 |
NeoR, a near-infrared absorbing rhodopsin M Broser, A Spreen, PE Konold, E Schiewer, S Adam, V Borin, I Schapiro, ... Nature communications 11 (1), 5682, 2020 | 53 | 2020 |
Roaming-mediated ultrafast isomerization of geminal tri-bromides in the gas and liquid phases AS Mereshchenko, EV Butaeva, VA Borin, A Eyzips, AN Tarnovsky Nature Chemistry 7 (7), 562-568, 2015 | 39 | 2015 |
Frontiers in multiscale modeling of photoreceptor proteins MA Mroginski, S Adam, GS Amoyal, A Barnoy, AN Bondar, VA Borin, ... Photochemistry and photobiology 97 (2), 243-269, 2021 | 27 | 2021 |
Disequilibrating azobenzenes by visible-light sensitization under confinement J Gemen, JR Church, TP Ruoko, N Durandin, MJ Białek, M Weißenfels, ... Science 381 (6664), 1357-1363, 2023 | 25 | 2023 |
Rhodopsin-bestrophin fusion proteins from unicellular algae form gigantic pentameric ion channels A Rozenberg, I Kaczmarczyk, D Matzov, J Vierock, T Nagata, M Sugiura, ... Nature structural & molecular biology 29 (6), 592-603, 2022 | 24 | 2022 |
Signal transduction in light-oxygen-voltage receptors lacking the active-site glutamine J Dietler, R Gelfert, J Kaiser, V Borin, C Renzl, S Pilsl, AT Ranzani, ... Nature Communications 13 (1), 2618, 2022 | 22 | 2022 |
Spectroscopic properties of Lumiflavin: a quantum chemical study RK Kar, VA Borin, Y Ding, J Matysik, I Schapiro Photochemistry and Photobiology 95 (2), 662-674, 2019 | 21 | 2019 |
Excitation energies of canonical nucleobases computed by multiconfigurational perturbation theories C Wiebeler, V Borin, AV Sanchez de Araujo, I Schapiro, AC Borin Photochemistry and photobiology 93 (3), 888-902, 2017 | 18 | 2017 |
Counterion-controlled spectral tuning of the protonated Schiff-base retinal Y Toker, J Langeland, E Gruber, C Kjær, SB Nielsen, LH Andersen, ... Physical Review A 98 (4), 043428, 2018 | 14 | 2018 |
A QM/MM study of the initial excited state dynamics of green-absorbing proteorhodopsin VA Borin, C Wiebeler, I Schapiro Faraday discussions 207, 137-152, 2018 | 14 | 2018 |
The impact of twisting on the intersystem crossing in acenes: an experimental and computational study P Malakar, V Borin, A Bedi, I Schapiro, O Gidron, S Ruhman Physical Chemistry Chemical Physics 24 (4), 2357-2362, 2022 | 10 | 2022 |
Insight into the isomerization mechanism of retinal proteins from hybrid quantum mechanics/molecular mechanics simulations S Sen, RK Kar, VA Borin, I Schapiro Wiley Interdisciplinary Reviews: Computational Molecular Science 12 (1), e1562, 2022 | 10 | 2022 |
Direct photoisomerization of CH 2 I 2 vs. CHBr 3 in the gas phase: a joint 50 fs experimental and multireference resonance-theoretical study VA Borin, SM Matveev, DS Budkina, PZ El-Khoury, AN Tarnovsky Physical Chemistry Chemical Physics 18 (41), 28883-28892, 2016 | 10 | 2016 |
Future COVID19 surges prediction based on SARS-CoV-2 mutations surveillance FZ Najar, E Linde, CL Murphy, VA Borin, H Wang, S Haider, PK Agarwal Elife 12, e82980, 2023 | 7 | 2023 |
Bending versus Twisting Acenes–A Computational Study AM Armon, A Bedi, V Borin, I Schapiro, O Gidron European Journal of Organic Chemistry 2021 (39), 5424-5429, 2021 | 6 | 2021 |
Efficient Synthesis of 1, 10-Phenantroline-5, 6-dione SA Miltsov, VS Karavan, VA Borin Russian Journal of General Chemistry 89, 1055-1057, 2019 | 6 | 2019 |
Deciphering the spectral tuning mechanism in proteorhodopsin: The dominant role of electrostatics instead of chromophore geometry JR Church, GS Amoyal, VA Borin, S Adam, JMH Olsen, I Schapiro Chemistry–A European Journal 28 (28), e202200139, 2022 | 5 | 2022 |