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Feature Transformation is crucial for classic machine learning that aims to generate feature combinations to enhance the performance of downstream tasks from a data-centric perspective. Current methodologies, such as manual expert-driven…

Machine Learning · Computer Science 2025-03-27 Tianqi He , Xiaohan Huang , Yi Du , Qingqing Long , Ziyue Qiao , Min Wu , Yanjie Fu , Yuanchun Zhou , Meng Xiao

Interactive data visualization is a major part of modern exploratory data analysis, with web-based technologies enabling a rich ecosystem of both specialized and general tools. However, current visualization tools often lack support for…

Human-Computer Interaction · Computer Science 2025-08-14 Jan Simson

Novel technologies and new materials are in high demand for future energy-efficient electronic devices to overcome the fundamental limitations of miniaturization of current silicon-based devices. Two-dimensional (2D) materials show…

Computational Physics · Physics 2021-12-20 Lei Shen , Jun Zhou , Tong Yang , Ming Yang , Yuan Ping Feng

Multi working-machines pathfinding solution enables more mobile machines simultaneously to work inside of a working site so that the productivity can be expected to increase evolutionary. To date, the potential cooperation conflicts among…

Artificial Intelligence · Computer Science 2021-05-17 Yusheng Xiang , Kailun Liu , Tianqing Su , Jun Li , Shirui Ouyang , Samuel S. Mao , Marcus Geimer

Over the past decade, machine learning model complexity has grown at an extraordinary rate, as has the scale of the systems training such large models. However there is an alarmingly low hardware utilization (5-20%) in large scale AI…

Hardware Architecture · Computer Science 2022-11-14 Newsha Ardalani , Saptadeep Pal , Puneet Gupta

Materials design is a critical driver of innovation, yet overlooking the technological, economic, and environmental risks inherent in materials and their supply chains can lead to unsustainable and risk-prone solutions. To address this, we…

Machine Learning · Computer Science 2024-09-25 Mrinalini Mulukutla , Robert Robinson , Danial Khatamsaz , Brent Vela , Nhu Vu , Raymundo Arróyave

Recent advances in visual analytics have enabled us to learn from user interactions and uncover analytic goals. These innovations set the foundation for actively guiding users during data exploration. Providing such guidance will become…

Human-Computer Interaction · Computer Science 2022-07-19 Shayan Monadjemi , Sunwoo Ha , Quan Nguyen , Henry Chai , Roman Garnett , Alvitta Ottley

The context of this paper is the creation of large uniform archaeological datasets from heterogeneous published resources, such as find catalogues - with the help of AI and Big Data. The paper is concerned with the challenge of consistent…

Computer Vision and Pattern Recognition · Computer Science 2025-03-24 Kevin Klein , Antoine Muller , Alyssa Wohde , Alexander V. Gorelik , Volker Heyd , Ralf Lämmel , Yoan Diekmann , Maxime Brami

Materials informatics offers a promising pathway towards rational materials design, replacing the current trial-and-error approach and accelerating the development of new functional materials. Through the use of sophisticated data analysis…

Materials Science · Physics 2018-05-17 Cormac Toher , Corey Oses , Stefano Curtarolo

Earth system science is producing increasingly large, high-dimensional datasets from physics based Earth system models to AI-based weather and climate models. Embedding-based representations can make these data searchable through similarity…

Data Analysis, Statistics and Probability · Physics 2026-05-05 Nihanth W. Cherukuru , Matt Rehme , Kirsten J. Mayer , David John Gagne , John Schreck , John Clyne , Charlie Becker

Machine learning interatomic potentials have revolutionized complex materials design by enabling rapid exploration of material configurational spaces via crystal structure prediction with ab initio accuracy. However, critical challenges…

The proliferation of data across the system lifecycle presents both a significant opportunity and a challenge for Engineering Design and Systems Engineering (EDSE). While this "digital thread" has the potential to drive innovation, the…

Software Engineering · Computer Science 2026-03-19 H. Sinan Bank , Daniel R. Herber

Recent advances in (scanning) transmission electron microscopy have enabled routine generation of large volumes of high-veracity structural data on 2D and 3D materials, naturally offering the challenge of using these as starting inputs for…

Data Analysis, Statistics and Probability · Physics 2022-11-08 Ayana Ghosh , Maxim Ziatdinov , Ondrej Dyck , Bobby Sumpter , Sergei V. Kalinin

Workflow is a common term used to describe a systematic breakdown of tasks that need to be performed to solve a problem. This concept has found best use in scientific and business applications for streamlining and improving the performance…

Distributed, Parallel, and Cluster Computing · Computer Science 2017-11-08 Samiya Khan , Kashish Ara Shakil , Mansaf Alam

The optimization of composition and processing to obtain materials that exhibit desirable characteristics has historically relied on a combination of scientist intuition, trial and error, and luck. We propose a methodology that can…

Machine Learning · Statistics 2017-07-20 Julia Ling , Max Hutchinson , Erin Antono , Sean Paradiso , Bryce Meredig

The collaborative efforts of large communities in science experiments, often comprising thousands of global members, reflect a monumental commitment to exploration and discovery. Recently, advanced and complex data processing has gained…

Advanced manufacturing with new bio-derived materials can be achieved faster and more economically with first-principle-based artificial intelligence and machine learning (AI/ML)-derived models and process optimization. Not only is this…

Soft Condensed Matter · Physics 2026-02-20 Rigoberto Advincula , Jihua Chen

The ability to find data is central to the FAIR principles underlying research data stewardship. As with the ability to reuse data, efforts to ensure and enhance findability have historically focused on discoverability of data by other…

Digital Libraries · Computer Science 2026-02-02 Bryan M. Gee

The past decade has seen unprecedented growth in active matter and autonomous biomaterials research, yielding diverse classes of materials that promise revolutionary applications such as self-healing infrastructure and self-sensing tissue…

Physics Education · Physics 2025-05-05 Megan T. Valentine , Rae M. Robertson-Anderson

The growth of digital storage capacities and diversity devices has had a significant time impact on digital forensic laboratories in law enforcement. Backlogs have become commonplace and increasingly more time is spent in the acquisition…

Cryptography and Security · Computer Science 2017-08-31 Ronald In de Braekt , Nhien-An Le-Khac , Jason Farina , Mark Scanlon , M-Tahar Kechadi