Xiaorui Wang

机构：Zhejiang University · ORCID：0000-0001-6893-2013

发表论文 45 篇 · 总被引 695 次 · h-index 15

代表论文

• Graph Neural Networks in Modern AI-Aided Drug Discovery (2025 · Chemical Reviews · 被引 67)
• Learning on topological surface and geometric structure for 3D molecular generation (2023 · Nature Computational Science · 被引 62)
• Multi-modal deep learning enables efficient and accurate annotation of enzymatic active sites (2024 · Nature Communications · 被引 41)
• Leveraging language model for advanced multiproperty molecular optimization via prompt engineering (2024 · Nature Machine Intelligence · 被引 37)
• HawkDock version 2: an updated web server to predict and analyze the structures of protein–protein complexes (2025 · Nucleic Acids Research · 被引 36)
• ClickGen: Directed exploration of synthesizable chemical space via modular reactions and reinforcement learning (2024 · Nature Communications · 被引 28)