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Artificial intelligence (AI) is influencing heterogeneous catalysis research by accelerating simulations and materials discovery. A key frontier is integrating AI with multiscale models and multimodal experiments to address the…

Chemical Physics · Physics 2025-10-23 Andrew J. Medford , Todd N. Whittaker , Bjarne Kreitz , David W. Flaherty , John R. Kitchin

This review explores the potential of foundation models to advance laboratory automation in the materials and chemical sciences. It emphasizes the dual roles of these models: cognitive functions for experimental planning and data analysis,…

We present an autonomous scanning droplet cell platform designed for on-demand alloy electrodeposition and real-time electrochemical characterization for investigating the corrosion-resistance properties of multicomponent alloys. Automation…

Materials Science · Physics 2022-04-01 Brian DeCost , Howie Joress , Suchismita Sarker , Apurva Mehta , Jason Hattrick-Simpers

A study of assisted problem solving formalized via decompositions of deterministic finite automata is initiated. The landscape of new types of decompositions of finite automata this study uncovered is presented. Languages with various…

Computational Complexity · Computer Science 2007-07-04 Peter Gaži , Branislav Rovan

Artificial intelligence (AI) has the potential to revolutionize the drug discovery process, offering improved efficiency, accuracy, and speed. However, the successful application of AI is dependent on the availability of high-quality data,…

While the uptake of data-driven approaches for materials science and chemistry is at an exciting, early stage, to realise the true potential of machine learning models for successful scientific discovery, they must have qualities beyond…

Materials Science · Physics 2022-06-28 Felipe Oviedo , Juan Lavista Ferres , Tonio Buonassisi , Keith Butler

With the rapid development of quantum technology, one of the leading applications is the simulation of chemistry. Interestingly, even before full scale quantum computers are available, quantum computer science has exhibited a remarkable…

Robotic surgery has increased the domain of surgeries possible. Several examples of partial surgical automation have been seen in the past decade. We break down the path of automation tasks into features required and provide a checklist…

Robotics · Computer Science 2022-06-22 Amritpal Singh

We describe a chemical robotic assistant equipped with a curiosity algorithm (CA) that can efficiently explore the state a complex chemical system can exhibit. The CA-robot is designed to explore formulations in an open-ended way with no…

Soft Condensed Matter · Physics 2019-04-30 Jonathan Grizou , Laurie J. Points , Abhishek Sharma , Leroy Cronin

The field of astronomy has arrived at a turning point in terms of size and complexity of both datasets and scientific collaboration. Commensurately, algorithms and statistical models have begun to adapt --- e.g., via the onset of artificial…

Autonomous scientific research is significantly advanced thanks to the development of AI agents. One key step in this process is finding the right scientific literature, whether to explore existing knowledge for a research problem, or to…

With most technical fields, there exists a delay between fundamental academic research and practical industrial uptake. Whilst some sciences have robust and well-established processes for commercialisation, such as the pharmaceutical…

Machine Learning · Computer Science 2022-11-09 Alexander Scriven , David Jacob Kedziora , Katarzyna Musial , Bogdan Gabrys

Maps have always been an essential component of autonomous driving. With the advancement of autonomous driving technology, both the representation and production process of maps have evolved substantially. The article categorizes the…

Computer Vision and Pattern Recognition · Computer Science 2025-09-17 Pengxin Chen , Zhipeng Luo , Xiaoqi Jiang , Zhangcai Yin , Jonathan Li

As modern scientific instruments generate vast amounts of data and the volume of information in the scientific literature continues to grow, machine learning (ML) has become an essential tool for organising, analysing, and interpreting…

The use of automation in digital forensic investigations is not only a technological issue, but also has political and social implications. This work discusses some challenges with the implementation and acceptance of automation in digital…

Computers and Society · Computer Science 2013-03-20 Joshua I. James , Pavel Gladyshev

The automated categorization (or classification) of texts into predefined categories has witnessed a booming interest in the last ten years, due to the increased availability of documents in digital form and the ensuing need to organize…

Information Retrieval · Computer Science 2021-09-21 Fabrizio Sebastiani

In many scientific fields, there is an interest in understanding the way in which complex chemical networks evolve. The chemical networks which researchers focus upon, have become increasingly complex and this has motivated the development…

The rapid advancement of artificial intelligence (AI) is changing our lives in many ways. One application domain is data science. New techniques in automating the creation of AI, known as AutoAI or AutoML, aim to automate the work practices…

Human-Computer Interaction · Computer Science 2019-09-06 Dakuo Wang , Justin D. Weisz , Michael Muller , Parikshit Ram , Werner Geyer , Casey Dugan , Yla Tausczik , Horst Samulowitz , Alexander Gray

The advent of autonomous vehicles has heralded a transformative era in transportation, reshaping the landscape of mobility through cutting-edge technologies. Central to this evolution is the integration of Artificial Intelligence (AI) and…

Machine Learning · Computer Science 2024-02-29 Divya Garikapati , Sneha Sudhir Shetiya
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