ChemBOMAS: Accelerated BO in Chemistry with LLM-Enhanced Multi-Agent System
机构 * Shanghai Artificial Intelligence Laboratory(上海人工智能实验室) ; Tongji University(同济大学) ; The University of Hong Kong(香港大学) ; Fudan University(复旦大学)
高校专区
机构 * Shanghai Artificial Intelligence Laboratory(上海人工智能实验室) ; Tongji University(同济大学) ; The University of Hong Kong(香港大学) ; Fudan University(复旦大学)
机构 * Shanghai Key Lab of Intell. Info. Processing, School of CS, Fudan University(上海智能信息处理关键实验室,复旦大学计算机学院) ; Shanghai Collaborative Innovation Center of Intelligent Visual Computing(上海智能视觉计算协同创新中心) ; HiThink Research(HiThink研究机构)
机构 * Institute of Science and Technology for Brain-Inspired Intelligence, Fudan University, Shanghai 200433, China(脑启发式智能科学与技术研究院,复旦大学,上海200433,中国) ; Key Laboratory of Computational Neuroscience and Brain-Inspired Intelligence (Fudan University), Ministry of Education, China(计算神经科学与脑启发式智能重点实验室(复旦大学),教育部,中国) ; MOE Frontiers Center for Brain Science, Fudan University, Shanghai 200433, China(教育部前沿脑科学中心(复旦大学),上海200433,中国) ; Ji Hua Laboratory, Foshan 528200, China(济华实验室,佛山528200,中国)
Comments 14 pages, 9 figures, 2 tables
机构 * Shanghai Key Laboratory of Data Science, School of Computer Science, Fudan University(上海数据科学关键实验室,计算机科学学院,复旦大学) ; School of Data Science, Fudan University(数据科学学院,复旦大学) ; Ant Group(蚂蚁集团)
机构 * College of Computer Science and Artificial Intelligence(计算机科学与人工智能学院) ; Fudan University(复旦大学) ; Institute of Modern Languages and Linguistics(现代语言与语言学研究所) ; Shanghai Key Laboratory of Intelligent Information Processing(上海智能信息处理重点实验室) ; Research Institute of Intelligent Complex Systems(智能复杂系统研究所) ; Institute of Trustworthy Embodied Artificial Intelligence(可信具身人工智能研究所) ; State Key Laboratory of Genetics and Development of Complex Phenotypes(复杂表型遗传与发育国家重点实验室)
Comments 66 pages. Accepted manuscript. Final version published in Proceedings of the National Academy of Sciences (PNAS): https://www.pnas.org/doi/10.1073/pnas.2512514122
Journal ref Proceedings of the National Academy of Sciences, U.S.A., 122 (44) e2512514122 (2025)