Benchmarking the ability of common docking programs to correctly reproduce and score binding modes in SARS-CoV-2 protease Mpro S Zev, K Raz, R Schwartz, R Tarabeh, PK Gupta, DT Major Journal of Chemical Information and Modeling 61 (6), 2957-2966, 2021 | 58 | 2021 |
Enzymatic control of product distribution in terpene synthases: insights from multiscale simulations K Raz, S Levi, PK Gupta, DT Major Current opinion in biotechnology 65, 248-258, 2020 | 29 | 2020 |
Enzydock: Protein–ligand docking of multiple reactive states along a reaction coordinate in enzymes S Das, M Shimshi, K Raz, N Nitoker Eliaz, AR Mhashal, T Ansbacher, ... Journal of Chemical Theory and Computation 15 (9), 5116-5134, 2019 | 29 | 2019 |
The impression of a nonexisting catalytic effect: the role of CotB2 in guiding the complex biosynthesis of cyclooctat-9-en-7-ol K Raz, R Driller, N Dimos, M Ringel, T Brück, B Loll, DT Major Journal of the American Chemical Society 142 (51), 21562-21574, 2020 | 20 | 2020 |
Current understanding and biotechnological application of the bacterial diterpene synthase CotB2 R Driller, D Garbe, N Mehlmer, M Fuchs, K Raz, DT Major, T Brück, B Loll Beilstein journal of organic chemistry 15 (1), 2355-2368, 2019 | 18 | 2019 |
Adsorption of Li2O2, Na2O2, and NaO2 on TiC(111) Surface for Metal–Air Rechargeable Batteries: A Theoretical Study K Raz, P Tereshchuk, D Golodnitsky, A Natan The Journal of Physical Chemistry C 122 (29), 16473-16480, 2018 | 14 | 2018 |
Understanding the role of active site residues in CotB2 catalysis using a cluster model K Raz, R Driller, T Brück, B Loll, DT Major Beilstein Journal of Organic Chemistry 16 (1), 50-59, 2020 | 11 | 2020 |
Theoretical Investigation of Li and Na Oxides Adsorption on TiC (111) Surface for Metal-Air Rechargeable Batteries K Raz, P Tereshchuk, D Golodnitsky, A Natan arXiv preprint arXiv:1710.09463, 2017 | 1 | 2017 |
Understanding the Role of Active Site Residues in CotB2 Catalysis Using a Cluster Model K Raz, R Driller, T Brück, B Loll, DT Major Beilstein Archives 2019 (1), 108, 2019 | | 2019 |