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Existing approaches to automatic data transformation are insufficient to meet the requirements in many real-world scenarios, such as the building sector. First, there is no convenient interface for domain experts to provide domain knowledge…

Large Language Models (LLMs) show great promise as a powerful tool for scientific literature exploration. However, their effectiveness in providing scientifically accurate and comprehensive answers to complex questions within specialized…

Transformer neural networks show promising capabilities, in particular for uses in materials analysis, design and manufacturing, including their capacity to work effectively with both human language, symbols, code, and numerical data. Here…

Computation and Language · Computer Science 2023-11-01 Markus J. Buehler

Large language models (LLMs) such as ChatGPT, Gemini, LlaMa, and Claude are trained on massive quantities of text parsed from the internet and have shown a remarkable ability to respond to complex prompts in a manner often indistinguishable…

Optics · Physics 2025-04-01 Darui Lu , Yang Deng , Jordan M. Malof , Willie J. Padilla

Decades accumulation of theory simulations lead to boom in material database, which combined with machine learning methods has been a valuable driver for the data-intensive material discovery, i.e., the fourth research paradigm. However,…

Materials Science · Physics 2025-02-10 Tiancheng Ma , Zihan Zhang , Shuting Wu , Defang Duan , Tian Cui

The advancement of data-driven materials science is currently constrained by a fundamental bottleneck: the vast majority of historical experimental data remains locked within the unstructured text and rasterized figures of legacy scientific…

Databases · Computer Science 2026-02-04 Yue Wu , Tianhao Su , Shunbo Hu , Deng Pan

Large language models (LLMs) are beginning to reshape how chemists plan and run reactions in organic synthesis. Trained on millions of reported transformations, these text-based models can propose synthetic routes, forecast reaction…

Artificial Intelligence · Computer Science 2025-08-08 Kartar Kumar Lohana Tharwani , Rajesh Kumar , Sumita , Numan Ahmed , Yong Tang

Reliable artificial-intelligence models have the potential to accelerate the discovery of materials with optimal properties for various applications, including superconductivity, catalysis, and thermoelectricity. Advancements in this field…

Materials Science · Physics 2023-06-07 Thomas A. R. Purcell , Matthias Scheffler , Luca M. Ghiringhelli , Christian Carbogno

Standard enthalpies of formation are used for assessing the efficiency and safety of chemical processes in the chemical industry. However, the number of compounds for which the enthalpies of formation are available is many orders of…

Computational Engineering, Finance, and Science · Computer Science 2013-02-05 Ana L. Teixeira , Rui C. Santos , Joao P. Leal , Jose A. Martinho Simoes , Andre O. Falcao

Authoring data-driven articles is a complex process requiring authors to not only analyze data for insights but also craft a cohesive narrative that effectively communicates the insights. Text generation capabilities of contemporary large…

Human-Computer Interaction · Computer Science 2023-08-09 Nicole Sultanum , Arjun Srinivasan

In today's visually dominated social media landscape, predicting the perceived credibility of visual content and understanding what drives human judgment are crucial for countering misinformation. However, these tasks are challenging due to…

Computer Vision and Pattern Recognition · Computer Science 2025-04-16 Yilang Peng , Sijia Qian , Yingdan Lu , Cuihua Shen

Large Language Models (LLMs) have shown remarkable proficiency in natural language understanding (NLU), opening doors for innovative applications. We introduce StreamLink - an LLM-driven distributed data system designed to improve the…

Databases · Computer Science 2025-05-29 Dawei Feng , Di Mei , Huiri Tan , Lei Ren , Xianying Lou , Zhangxi Tan

Conventional predictive modeling of parametric relationships in manufacturing processes is limited by the subjectivity of human expertise and intuition on the one hand and by the cost and time of experimental data generation on the other…

Computation and Language · Computer Science 2025-06-26 Kiarash Naghavi Khanghah , Anandkumar Patel , Rajiv Malhotra , Hongyi Xu

Thermoelectrics (TEs) are promising candidates for energy harvesting with performance quantified by figure of merit, $ZT$. To accelerate the discovery of high-$ZT$ materials, efforts have focused on identifying compounds with low thermal…

Materials Science · Physics 2026-04-28 Yifan Sun , Zhi Li , Tetsuya Imamura , Yuji Ohishi , Chris Wolverton , Ken Kurosaki

Automatically extracting effective queries is challenging in information retrieval, especially in toxic content exploration, as such content is likely to be disguised. With the recent achievements in generative Large Language Model (LLM),…

Information Retrieval · Computer Science 2025-02-27 Shaola Ren , Li Ke , Longtao Huang , Dehong Gao , Hui Xue

As multiple crises threaten the sustainability of our societies and pose at risk the planetary boundaries, complex challenges require timely, updated, and usable information. Natural-language processing (NLP) tools enhance and expand data…

Computers and Society · Computer Science 2025-02-05 Francesca Larosa , Sergio Hoyas , H. Alberto Conejero , Javier Garcia-Martinez , Francesco Fuso Nerini , Ricardo Vinuesa

The usefulness of Large Language Models (LLM) is being continuously tested in various fields. However, their intrinsic linguistic characteristic is still one of the limiting factors when applying these models to exact sciences. In this…

Artificial Intelligence · Computer Science 2024-09-24 Jonathan Paul Driemeyer Brown , Tiago Oliveira Weber

This study applies Large Language Models (LLMs) to two foundational Electronic Health Record (EHR) data science tasks: structured data querying (using programmatic languages, Python/Pandas) and information extraction from unstructured…

Computation and Language · Computer Science 2026-01-29 Juan Jose Rubio Jan , Jack Wu , Julia Ive

This article analyzes the use of Large Language Models (LLMs) as support for the conceptual modeling of relational databases through the automatic generation of Entity-Relationship (ER) diagrams from natural language requirements. The…

Artificial Intelligence · Computer Science 2026-05-13 Arthur F. Siqueira , Carlos D. S. Nogueira , Eduarda Farias , Claudio E. C. Campelo , Júlia Menezes

Large language models (LLMs) are a class of artificial intelligence models based on deep learning, which have great performance in various tasks, especially in natural language processing (NLP). Large language models typically consist of…

Quantitative Methods · Quantitative Biology 2025-02-04 Jiajia Liu , Mengyuan Yang , Yankai Yu , Haixia Xu , Tiangang Wang , Kang Li , Xiaobo Zhou
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