Structured information extraction from scientific text with large language models.

Dagdelen, John; Dunn, Alexander; Lee, Sanghoon; Walker, Nicholas; Rosen, Andrew S; Ceder, Gerbrand; Persson, Kristin A; Jain, Anubhav · Nat Commun · 2024

basic_science · Level V

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Abstract

Extracting structured knowledge from scientific text remains a challenging task for machine learning models. Here, we present a simple approach to joint named entity recognition and relation extraction and demonstrate how pretrained large language models (GPT-3, Llama-2) can be fine-tuned to extract useful records of complex scientific knowledge. We test three representative tasks in materials chemistry: linking dopants and host materials, cataloging metal-organic frameworks, and general composition/phase/morphology/application information extraction. Records are extracted from single sentences or entire paragraphs, and the output can be returned as simple English sentences or a more structured format such as a list of JSON objects. This approach represents a simple, accessible, and highly flexible route to obtaining large databases of structured specialized scientific knowledge extracted from research papers.