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BiochemistrybioRxiv
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Enzyme Co-Scientist: Harnessing Large Language Models for Enzyme Kinetic Data Extraction from Literature

Jinling JiangiD, Jie HuiD, Siwei Xie, Meng-Hao GuoiD, Yuhang DongiD, Shuai FuiD, Xianyue Jiang, Zhenlei Yue, Junchao ShiiD, Xiaoyu ZhangiD, Minghui SongiD, Guangyong CheniD, Hua Lu, Xindong WuiD, Pei GuoiD, Da HaniD, Zeyi SuniD, Jiezhong QiuiD

Abstract

The extraction of molecular annotations from scientific literature is critical for advancing data-driven research. However, traditional methods, which primarily rely on human curation, are labor-intensive and error-prone. Here, we present an LLM-based agentic workflow that enables automatic and efficient data extraction from literature with high accuracy. As a demonstration, our workflow successfully delivers a dataset containing over 91,000 enzyme kinetics entries from around 3,500 papers. It achieves an average F1 score above 0.9 on expert-annotated subsets of protein enzymes and can be extended to the ribozyme domain in fewer than 3 days at less than $90. This method opens up new avenues for accelerating the pace of scientific research.

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