Dmytro S. Radchenko

An open-source drug discovery platform enables ultra-large virtual screens

Christoph Gorgulla, Andras Boeszoermenyi, Zifu Wang et al. · Nature · 2020 · 612 citations · Full text

Virtual Screening, Hit Identification, Medicine +5

Synthon-based ligand discovery in virtual libraries of over 11 billion compounds

Arman A. Sadybekov, Anastasiia Sadybekov, Yongfeng Liu et al. · Nature · 2021 · 415 citations · Full text

Combinatorial Chemistry, Targeted Library, Medicinal Chemistry +11

Generating Multibillion Chemical Space of Readily Accessible Screening Compounds

Oleksandr O. Grygorenko, Dmytro S. Radchenko, Igor Dziuba et al. · iScience · 2020 · 196 citations · Full text

Structures of the σ2 receptor enable docking for bioactive ligand discovery

Assaf Alon, Jiankun Lyu, João M. Bráz et al. · Nature · 2021 · 190 citations · Full text

Biochemistry, Medicine, Natural Sciences +7

Iterative computational design and crystallographic screening identifies potent inhibitors targeting the Nsp3 macrodomain of SARS-CoV-2

Stefan Gahbauer, G.J. Correy, M. Schuller et al. · Proceedings of the National Academy of Sciences · 2023 · 117 citations · Full text

Drug Target, Protein Assembly, Biomolecular Structure Prediction +17