A multi-agent molecular optimization framework leads to a rapid-recovery intravenous anesthetic candidate with an improved safety margin
Z. Y. Xue, Wei Ai, Zhuang Miao, Jinhui Sun, Zilin Wang, Wencheng Liu, Yifan Shi, Jiancheng Lv, Xianggen Liu, Bowen Ke
The paper introduces MASCOT, a multi-agent framework for molecular optimization, which improves anesthetic candidates with better safety and recovery properties.
bioRxiv · Aug 20, 2026 · PreprintBioinformatics