Lune

ACL Findings2023

ReactIE: Enhancing Chemical Reaction Extraction with Weak Supervision

Ming Zhong, Siru Ouyang, Minhao Jiang, Vivian Hu, Yizhu Jiao, Xuan Wang, Jiawei Han

Abstract

Structured chemical reaction information plays a vital role for chemists engaged in laboratory work and advanced endeavors such as computer-aided drug design. Despite the importance of extracting structured reactions from scientific literature, data annotation for this purpose is cost-prohibitive due to the significant labor required from domain experts. Consequently, the scarcity of sufficient training data poses an obstacle to the progress of related models in this domain. In this paper, we propose REACTIE, which combines two weakly supervised approaches for pre-training. Our method utilizes frequent patterns within the text as linguistic cues to identify specific characteristics of chemical reactions. Additionally, we adopt synthetic data from patent records as distant supervision to incorporate domain knowledge into the model. Experiments demonstrate that REACTIE achieves substantial improvements and outperforms all existing baselines.

Ask Lune

Ask anything. The answer quotes the paper.

Lune reads all of it and the papers around it, then shows you the passages behind every answer.

Questions to start from

Lune answers from

the full paper · 5 top-tier papers that cite it · related work

Get the answer

Free to start. No credit card required.

Cited by top-tier papers5

  1. ReactGPT: Understanding of Chemical Reactions via In-Context TuningZhe Chen, Zhe Fang, Wenhao Tian, Zhaoguang Long et al.AAAI 2025 · 11 citations
  2. Ontology Enrichment for Effective Fine-grained Entity TypingSiru Ouyang, Jiaxin Huang, Pranav Pillai, Yunyi Zhang et al.KDD 2024 · 5 citations
  3. RxnCaption: Reformulating Reaction Diagram Parsing as Visual Prompt Guided CaptioningJiahe Song, Chuang Wang, Bowen Jiang, Yinfan Wang et al.CVPR 2026 · 3 citations
  4. ActionIE: Action Extraction from Scientific Literature with Programming LanguagesXianrui Zhong, Yufeng Du, Siru Ouyang, Ming Zhong et al.ACL 2024
  5. ChemAgent: Self-updating Memories in Large Language Models Improves Chemical ReasoningXiangru Tang, Tianyu Hu, Muyang Ye, Yanjun Shao et al.ICLR 2025

Builds on4

  1. Translation between Molecules and Natural LanguageCarl Edwards, Tuan Manh Lai, Kevin Ros, Garrett Honke et al.EMNLP 2022 · 112 citations
  2. AdaPrompt: Adaptive Model Training for Prompt-based NLPYulong Chen, Yang Liu, Li Dong, Shuohang Wang et al.EMNLP Findings 2022 · 44 citations
  3. ChemNER: Fine-Grained Chemistry Named Entity Recognition with Ontology-Guided Distant SupervisionXuan Wang, Vivian Hu, Xiangchen Song, Shweta Garg et al.EMNLP 2021 · 23 citations
  4. Open-Vocabulary Argument Role Prediction For Event ExtractionYizhu Jiao, Sha Li, Yiqing Xie, Ming Zhong et al.EMNLP Findings 2022 · 11 citations

Related papers

  1. Predictive Chemistry Augmented with Text RetrievalYujie Qian, Zhening Li, Zhengkai Tu, Connor W. Coley et al.EMNLP 2023 · 11 citations
  2. ReactXT: Understanding Molecular "Reaction-ship" via Reaction-Contextualized Molecule-Text PretrainingZhiyuan Liu, Yaorui Shi, An Zhang, Sihang Li et al.ACL Findings 2024 · 4 citations
  3. ChemActor: Enhancing Automated Extraction of Chemical Synthesis Actions with LLM-Generated DataYu Zhang, Ruijie Yu, Jidong Tian, Feng Zhu et al.ACL 2025 · 3 citations
  4. MolTRES: Improving Chemical Language Representation Learning for Molecular Property PredictionJun-Hyung Park, Yeachan Kim, Mingyu Lee, Hyuntae Park et al.EMNLP 2024 · 2 citations
  5. BioT5: Enriching Cross-modal Integration in Biology with Chemical Knowledge and Natural Language AssociationsQizhi Pei, Wei Zhang, Jinhua Zhu, Kehan Wu et al.EMNLP 2023 · 40 citations
Dusk over the sea between two cliffs drawn in fine vertical lines