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Data Science research is undergoing a revolution fueled by the transformative power of technology, the Internet, and an ever increasing computational capacity. The rate at which sophisticated algorithms can be developed is unprecedented,…

The rapid growth of AI agent ecosystems is transforming how complex tasks are delegated and executed, creating a new challenge of identifying suitable agents for a given task. Unlike traditional tools, agent capabilities are often…

Artificial Intelligence · Computer Science 2026-04-27 Bin Wu , Arastun Mammadli , Xiaoyu Zhang , Emine Yilmaz

The ability to create artificial intelligence (AI) capable of performing complex tasks is rapidly outpacing our ability to ensure the safe and assured operation of AI-enabled systems. Fortunately, a landscape of AI safety research is…

Data-driven artificial intelligence models fed with published scientific findings have been used to create powerful prediction engines for scientific and technological advance, such as the discovery of novel materials with desired…

Artificial Intelligence · Computer Science 2021-04-13 Jamshid Sourati , James Evans

Generative AI systems have entered everyday academic, professional, and personal life with remarkable speed, yet most users encounter them as mysterious artifacts rather than intelligible systems. This chapter discusses large language…

Computers and Society · Computer Science 2026-04-21 John T. Behrens

The integration of artificial intelligence (AI) into science education is transforming the design and function of learning materials, offering new affordances for personalization, authenticity, and accessibility. This chapter examines how…

Computers and Society · Computer Science 2026-02-25 Xiaoming Zhai , Kent Crippen

The use of artificial intelligence (AI) in research across all disciplines is becoming ubiquitous. However, this ubiquity is largely driven by hyperspecific AI models developed during scientific studies for accomplishing a well-defined,…

Computers and Society · Computer Science 2023-12-19 Rishab Jain , Aditya Jain

Accelerated material discovery increasingly relies on artificial intelligence and machine learning, collectively termed "AI/ML". A key challenge in using AI is ensuring that human scientists trust the models are valid and reliable.…

Materials Science · Physics 2025-12-02 Benhour Amirian , Ashley S. Dale , Sergei Kalinin , Jason Hattrick-Simpers

Despite the promises of data-driven artificial intelligence (AI), little is known about how we can bridge the gulf between traditional physician-driven diagnosis and a plausible future of medicine automated by AI. Specifically, how can we…

Human-Computer Interaction · Computer Science 2021-02-12 Hongyan Gu , Jingbin Huang , Lauren Hung , Xiang 'Anthony' Chen

The rapid advancement of artificial intelligence (AI) has demonstrated substantial potential in chemical engineering, yet existing AI systems remain limited in interdisciplinary collaboration and exploration of uncharted problems. To…

Artificial Intelligence · Computer Science 2025-10-03 Zekun Jiang , Chunming Xu , Tianhang Zhou

This study presents a design science blueprint for an orchestrated AI assistant and co-pilot in doctoral supervision that acts as a socio-technical mediator. Design requirements are derived from Stakeholder Theory and bounded by Academic…

Computers and Society · Computer Science 2025-10-23 Teo Susnjak , Timothy R. McIntosh , Tong Liu , Paul Watters

As AI systems become increasingly powerful, the need for safe AI has become more pressing. Humans are an attractive model for AI safety: as the only known agents capable of general intelligence, they perform robustly even under conditions…

This report documents the programme and the outcomes of Dagstuhl Seminar 22382 "Machine Learning for Science: Bridging Data-Driven and Mechanistic Modelling". Today's scientific challenges are characterised by complexity. Interconnected…

Artificial Intelligence · Computer Science 2023-03-09 Philipp Berens , Kyle Cranmer , Neil D. Lawrence , Ulrike von Luxburg , Jessica Montgomery

Scientific discovery increasingly relies on integrating heterogeneous, high-dimensional data across disciplines nowadays. While AI models have achieved notable success across various scientific domains, they typically remain domain-specific…

Artificial Intelligence · Computer Science 2026-01-06 Xiaomeng Yang , Zhiyu Tan , Xiaohui Zhong , Mengping Yang , Qiusheng Huang , Lei Chen , Libo Wu , Hao Li

Tackling the most pressing problems for humanity, such as the climate crisis and the threat of global pandemics, requires accelerating the pace of scientific discovery. While science has traditionally relied on trial and error and even…

Machine Learning · Computer Science 2023-06-28 Moksh Jain , Tristan Deleu , Jason Hartford , Cheng-Hao Liu , Alex Hernandez-Garcia , Yoshua Bengio

Data science is an integrated workflow of technical, analytical, communication, and ethical skills, but current AI benchmarks focus mostly on constituent parts. We test whether AI models can generate end-to-end data science projects. To do…

Other Statistics · Statistics 2026-02-17 Evelyn Hughes , Rohan Alexander

Artificial intelligence (AI) is transforming the practice of science. Machine learning and large language models (LLMs) can generate hypotheses at a scale and speed far exceeding traditional methods, offering the potential to accelerate…

Artificial Intelligence · Computer Science 2025-12-18 Cristina Cornelio , Takuya Ito , Ryan Cory-Wright , Sanjeeb Dash , Lior Horesh

Fully leveraging the capabilities of AI agents in software development requires a rethinking of the software ecosystem itself. To this end, this paper outlines the creation of an Agentic Infused Software Ecosystem (AISE), that rests on…

Software Engineering · Computer Science 2026-02-25 Mark Marron

In recent years, discussions about fairness in machine learning, AI ethics and algorithm audits have increased. Many entities have developed framework guidance to establish a baseline rubric for fairness and accountability. However, in…

Machine Learning · Computer Science 2022-06-23 Cherie M Poland

Data science plays a critical role in transforming complex data into actionable insights across numerous domains. Recent developments in large language models (LLMs) and artificial intelligence (AI) agents have significantly automated data…

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