| 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 | 59 | 2021 |
| Four-step access to the sesquiterpene natural product presilphiperfolan-1β-ol and unnatural derivatives via supramolecular catalysis LD Syntrivanis, I Némethová, D Schmid, S Levi, A Prescimone, ... Journal of the American Chemical Society 142 (12), 5894-5900, 2020 | 56 | 2020 |
| 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 | 33 | 2020 |
| A benchmark study of quantum mechanics and quantum mechanics-molecular mechanics methods for carbocation chemistry S Zev, PK Gupta, E Pahima, DT Major Journal of Chemical Theory and Computation 18 (1), 167-178, 2021 | 14 | 2021 |
| Concentration‐Dependent Self‐Assembly of an Unusually Large Hexameric Hydrogen‐Bonded Molecular Cage S Merget, L Catti, S Zev, DT Major, N Trapp, K Tiefenbacher Chemistry–A European Journal 27 (13), 4447-4453, 2021 | 13 | 2021 |
| Thermodynamic and Kinetic Control Determine the Sesquiterpene Reaction Pathways Inside Nanocapsules S Levi, Q Zhang, DT Major ACS Catalysis 10 (12), 6843-6853, 2020 | 7 | 2020 |
| UTILIZING PERTURBATION OF ATOMS’POSITIONS FOR EQUIVARIANT PRE-TRAINING IN 3D MOLECULAR ANALYSIS T Kiani, A Caciularu, S Zev, DT Major, J Goldberger | 1 | 2023 |
| Differential Substrate Sensing in Terpene Synthases from Plants and Microorganisms. Insights from Structural, Bioinformatic, and EnzyDock Analyses R Schwartz, S Zev, DT Major Angewandte Chemie International Edition, e202400743, 2024 | | 2024 |
| Multistate multiscale docking study of the hydrolysis of toxic nerve agents by phosphotriesterase PK Gupta, N Tarannam, S Zev, DT Major Electronic Structure 5 (3), 035003, 2023 | | 2023 |
| Understanding the competing pathways leading to hydropyrene and isoelisabethatriene S Zev, M Ringel, R Driller, B Loll, T Brück, DT Major Beilstein Journal of Organic Chemistry 18 (1), 972-978, 2022 | | 2022 |
| Supramolecular Catalysis Permits Access to the Presilphiperfolanol Framework B List, M Turberg Synfacts 16 (06), 0709, 2020 | | 2020 |
Dan Thomas MajorProfessor of Chemistry, Bar-Ilan UniversityVerified email at biu.ac.il
