Anna Kapeliukha

机构：Medpace (United States), Taras Shevchenko National University of Kyiv

发表论文 4 篇 · 总被引 13 次 · h-index 2

代表论文

• The freedom space – a new set of commercially available molecules for hit discovery (2024 · Molecular Informatics · 被引 9)
• Freedom Space 3.0: ML-Assisted Selection of Synthetically Accessible Small Molecules (2025 · Journal of Chemical Information and Modeling · 被引 4)
• Evaluation of Custom REINVENT Priors Trained on Synthetically Accessible Chemical Spaces for Generative Molecular Design (2026 · ChemRxiv)
• Creation of targeted compound libraries based on 3D shape recognition (2022 · Molecular Diversity)