Wanglin Qu

机构：Shanghai Jiao Tong University

发表论文 5 篇 · 总被引 202 次 · h-index 3

代表论文

Efficient and accurate large library ligand docking with KarmaDock (2023 · Nature Computational Science · 被引 164)
Deep lead optimization enveloped in protein pocket and its application in designing potent and selective ligands targeting LTK protein (2025 · Nature Machine Intelligence · 被引 25)
A Multi‐Objective Molecular Generation Method Based on Pareto Algorithm and Monte Carlo Tree Search (2025 · Advanced Science · 被引 12)
Discovery of adamantyl derivatives as potent and selective TRPM2 inhibitors with significantly reduced hERG liability (2025 · European Journal of Medicinal Chemistry · 被引 1)
Modulating Interfacial Molecular Vibration for Enhanced CO Electrolysis via Coated-Carbon Layers (2026 · ACS Catalysis)