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Methods in Enzymology|June 28, 2024
Mechanistic docking in terpene synthases using EnzyDockRenana Schwartz, Shani Zev, Dan T MajorAngewandte Chemie (International Ed. in English)|March 31, 2024
Differential Substrate Sensing in Terpene Synthases from Plants and Microorganisms: Insight from Structural, Bioinformatic, and EnzyDock AnalysesRenana Schwartz, Shani Zev, Dan T MajorJournal of Chemical Theory and Computation|February 14, 2025
CHARMM-GUI EnzyDocker for Protein-Ligand Docking of Multiple Reactive States along a Reaction Coordinate in EnzymesDonghyuk Suh, Renana Schwartz, Prashant Kumar Gupta, et al.Journal of Chemical Information and Modeling|May 28, 2021
Benchmarking the Ability of Common Docking Programs to Correctly Reproduce and Score Binding Modes in SARS-CoV-2 Protease MproShani Zev, Keren Raz, Renana Schwartz, et al.Journal of Chemical Information and Modeling|May 19, 2025
Template-Based Docking Using Automated Maximum Common Substructure Identification with EnzyDock: Mechanistic and Inhibitor DockingRenana Schwartz, Amit Hadar-Volk, Kwangho Nam, et al.Journal of Chemical Theory and Computation|March 9, 2026
RxnNet: An AI Framework for Reaction Mechanism Discovery─A Case Study of CarbocationsShani Zev, Michal Roth, Jishnu Narayanan S J, et al.Beilstein Journal of Organic Chemistry|August 15, 2022
Understanding the competing pathways leading to hydropyrene and isoelisabethatrieneShani Zev, Marion Ringel, Ronja Driller, et al.Chemistry (Weinheim an Der Bergstrasse, Germany)|December 21, 2020
Concentration-Dependent Self-Assembly of an Unusually Large Hexameric Hydrogen-Bonded Molecular CageSeverin Merget, Lorenzo Catti, Shani Zev, et al.FEBS Letters|March 19, 2026
A methionine-lined active site governs carbocation stabilization and product specificity in a bacterial terpene synthaseMarion Ringel, Carl P O Helmer, Shani Zev, et al.Journal of Medicinal Chemistry|August 20, 2004
Molecular recognition in purinergic receptors. 1. A comprehensive computational study of the h-P2Y1-receptorDan T Major, Bilha FischerPageof 6