3 papers
cs.LG2026
PoseX: AI Defeats Physics Approaches on Protein-Ligand Cross Docking
Yize Jiang, Xinze Li, Yuanyuan Zhang +13
Existing protein-ligand docking studies typically focus on the self-docking scenario, which is less practical in real applications. Moreover, some studies involve heavy frameworks…
quant-ph2025
Quantum-machine-assisted Drug Discovery
Yidong Zhou, Jintai Chen, Jinglei Cheng +8
Drug discovery is lengthy and expensive, with traditional computer-aided design facing limits. This paper examines integrating quantum computing across the drug development cycle t…
cs.LG2025
Foundation Model in Biomedicine
Xiangrui Liu, Yuanyuan Zhang, Qianyu Shang +14
Foundation models, first introduced in 2021, refer to large-scale pretrained models (e.g., large language models (LLMs) and vision-language models (VLMs)) that learn from extensive…