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Materials science workflows rely on structured and unstructured data from the vast body of available scientific literature. However, most of the experimental details remain buried in text, tables, graphs and figures. Thus, constructing…

Computation and Language · Computer Science 2026-05-07 Achuth Chandrasekhar , Omid Barati Farimani , Radheesh Sharma Meda , Amir Barati Farimani

We present a demonstration of the utility of NLP for aiding research into energetic materials and associated systems. The NLP method enables machine understanding of textual data, offering an automated route to knowledge discovery and…

Computation and Language · Computer Science 2024-02-13 Francis G. VanGessel , Efrem Perry , Salil Mohan , Oliver M. Barham , Mark Cavolowsky

Technical documents contain a fair amount of unnatural language, such as tables, formulas, pseudo-codes, etc. Unnatural language can be an important factor of confusing existing NLP tools. This paper presents an effective method of…

Information Retrieval · Computer Science 2017-03-20 Myungha Jang , Jinho D. Choi , James Allan

Data-driven approaches for material discovery and design have been accelerated by emerging efforts in machine learning. However, general representations of crystals to explore the vast material search space remain limited. We introduce a…

Materials science literature contains millions of materials synthesis procedures described in unstructured natural language text. Large-scale analysis of these synthesis procedures would facilitate deeper scientific understanding of…

Computation and Language · Computer Science 2019-07-16 Sheshera Mysore , Zach Jensen , Edward Kim , Kevin Huang , Haw-Shiuan Chang , Emma Strubell , Jeffrey Flanigan , Andrew McCallum , Elsa Olivetti

A crucial component in the curation of KB for a scientific domain (e.g., materials science, foods & nutrition, fuels) is information extraction from tables in the domain's published research articles. To facilitate research in this…

Computation and Language · Computer Science 2024-01-30 Tanishq Gupta , Mohd Zaki , Devanshi Khatsuriya , Kausik Hira , N. M. Anoop Krishnan , Mausam

Current language understanding approaches focus on small documents, such as newswire articles, blog posts, product reviews and discussion forum entries. Understanding and extracting information from large documents like legal briefs,…

Computation and Language · Computer Science 2017-09-05 Muhammad Mahbubur Rahman , Tim Finin

Large language models (LLMs) have demonstrated rapid progress across a wide array of domains. Owing to the very large number of parameters and training data in LLMs, these models inherently encompass an expansive and comprehensive materials…

Materials Science · Physics 2024-11-20 Siyu Liu , Tongqi Wen , A. S. L. Subrahmanyam Pattamatta , David J. Srolovitz

Leveraging new data sources is a key step in accelerating the pace of materials design and discovery. To complement the strides in synthesis planning driven by historical, experimental, and computed data, we present an automated method for…

We introduce an NLP toolkit based on object-oriented knowledge base and multi-level grammar base. This toolkit focuses on semantic parsing, it also has abilities to discover new knowledge and grammar automatically, new discovered knowledge…

Computation and Language · Computer Science 2021-06-09 Yu Guo

Knowledge in materials science is widely dispersed across extensive scientific literature, posing significant challenges to the efficient discovery and integration of new materials. Traditional methods, often reliant on costly and…

Computation and Language · Computer Science 2025-05-16 Yanpeng Ye , Jie Ren , Shaozhou Wang , Yuwei Wan , Imran Razzak , Bram Hoex , Haofen Wang , Tong Xie , Wenjie Zhang

This paper describes a machine learning and data science pipeline for structured information extraction from documents, implemented as a suite of open-source tools and extensions to existing tools. It centers around a methodology for…

We must recognize that natural language is a way of information encoding, and it encodes not only the information but also the procedures for how information is processed. To understand natural language, the same as we conceive and design…

Computation and Language · Computer Science 2021-01-13 Limin Zhang

Significant advancements have been made in one of the most critical branches of artificial intelligence: natural language processing (NLP). These advancements are exemplified by the remarkable success of OpenAI's GPT-3.5/4 and the recent…

Materials Science · Physics 2025-04-22 Zongrui Pei , Junqi Yin , Jiaxin Zhang

Large Language Models (LLMs) are increasingly utilized for large-scale extraction and organization of unstructured data owing to their exceptional Natural Language Processing (NLP) capabilities. Empowering materials design, vast amounts of…

Digital Libraries · Computer Science 2025-12-11 Wenkai Ning , Musen Li , Jeffrey R. Reimers , Rika Kobayashi

Explorative flow visualization allows domain experts to analyze complex flow structures by interactively investigating flow patterns. However, traditional visual interfaces often rely on specialized graphical representations and…

Human-Computer Interaction · Computer Science 2025-08-11 Weihan Zhang , Jun Tao

In the field of inorganic materials science, there is a growing demand to extract knowledge such as physical properties and synthesis processes of materials by machine-reading a large number of papers. This is because materials researchers…

Computation and Language · Computer Science 2021-06-29 Fusataka Kuniyoshi , Jun Ozawa , Makoto Miwa

Materials design often relies on human-generated hypotheses, a process inherently limited by cognitive constraints such as knowledge gaps and limited ability to integrate and extract knowledge implications, particularly when…

Abundant and diverse data on medicines manufacturing and other lifecycle components has been made easily accessible in the last decades. However, a significant proportion of this information is characterised by not being tabulated and…

Information Retrieval · Computer Science 2025-05-02 Diego Alvarado-Maldonado , Blair Johnston , Cameron J. Brown

Accurate and comprehensive material databases extracted from research papers are crucial for materials science and engineering, but their development requires significant human effort. With large language models (LLMs) transforming the way…