返回全部动态

SynthEx:基于大语言模型的复杂天然产物合成规划框架

原标题:Strategy-first synthesis planning for complex natural products

arXiv cs.MA一手来源研究质量 80

AI 摘要

arXiv 上发布了一项研究,介绍了基于大语言模型的智能体框架 SynthEx,用于复杂天然产物的逆合成路线规划。SynthEx 能提出竞争性策略、组装反应步骤并自我改进,其设计的关键步骤在盲评中获得专家化学家的认可,优于传统目录式工具。研究还发布了包含一千多种天然产物路线的开放数据库 SynthAtlas。

以上摘要由 AI 生成,可能存在误差。事实请以原文为准。

正文节选

Computer Science > Multiagent Systems Title:Strategy-first synthesis planning for complex natural products View PDF HTML (experimental) Abstract:The total synthesis of a complex molecule is among the most demanding intellectual and experimental feats in chemistry: a chemist must plan many steps ahead for how to assemble simple building blocks into an intricate target, devise backup strategies, and anticipate procedural challenges. It is also a profoundly creative activity. For half a


发布时间:2026-08-10 12:00
抓取时间:2026-08-10 13:04
来源机构:arXiv
阅读原文arxiv.org