Evgeny Gutkin

机构：Carnegie Mellon University · ORCID：0000-0003-4522-6049

发表论文 25 篇 · 总被引 175 次 · h-index 5

代表论文

• Active Learning Guided Drug Design Lead Optimization Based on Relative Binding Free Energy Modeling (2023 · Journal of Chemical Information and Modeling · 被引 70)
• CACHE Challenge #1: Targeting the WDR Domain of LRRK2, A Parkinson’s Disease Associated Protein (2024 · Journal of Chemical Information and Modeling · 被引 27)
• In silico screening of LRRK2 WDR domain inhibitors using deep docking and free energy simulations (2024 · Chemical Science · 被引 26)
• A community effort in SARS‐CoV‐2 drug discovery (2023 · Molecular Informatics · 被引 19)
• Active learning guided drug design lead optimization based on relative binding free energy modeling (2022 · ChemRxiv · 被引 9)
• CACHE Challenge #1: targeting the WDR domain of LRRK2, a Parkinson’s Disease associated protein (2024 · bioRxiv (Cold Spring Harbor Laboratory) · 被引 5)