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Recent advances in language model (LM) agents and function calling have enabled autonomous, feedback-driven systems to solve problems across various digital domains. To better understand the unique limitations of LM agents, we introduce…

Artificial Intelligence · Computer Science 2025-03-12 Dhruv Gautam , Spandan Garg , Jinu Jang , Neel Sundaresan , Roshanak Zilouchian Moghaddam

Artificial intelligence (AI) is reshaping scientific discovery, evolving from specialized computational tools into autonomous research partners. We position Agentic Science as a pivotal stage within the broader AI for Science paradigm,…

We introduce the AI co-mathematician, a workbench for mathematicians to interactively leverage AI agents to pursue open-ended research. The AI co-mathematician is optimized to provide holistic support for the exploratory and iterative…

LLM-based reasoning models have enabled the development of agentic systems that act as co-scientists, assisting in multi-step scientific analysis. However, evaluating these systems is challenging, as it requires realistic, end-to-end…

Machine Learning · Computer Science 2026-02-24 Siba Smarak Panigrahi , Jovana Videnović , Maria Brbić

Today's AI models learn primarily through mimicry and refining, so it is not surprising that they struggle to solve problems beyond the limits set by existing data. To solve novel problems, agents should acquire skills for exploring and…

Artificial Intelligence · Computer Science 2026-03-25 Raj Ghugare , Roger Creus Castanyer , Catherine Ji , Kathryn Wantlin , Jin Schofield , Karthik Narasimhan , Benjamin Eysenbach

While large language models have significantly accelerated scientific code generation, comprehensively evaluating the generated code remains a major challenge. Traditional benchmarks reduce evaluation to test-case matching, an approach…

Artificial Intelligence · Computer Science 2026-03-18 Hong Zhang , Barry Smith , Satish Balay , Le Chen , Murat Keceli , Lois Curfman McInnes , Junchao Zhang

Large language model (LLM) agents have demonstrated remarkable potential in advancing scientific discovery. However, their capability in the fundamental yet crucial task of reproducing code from research papers, especially in the NLP…

Decentralized, agentic AI marketplaces are rapidly emerging to support software engineering tasks such as debugging, patch generation, and security auditing, often operating without centralized oversight. However, existing reputation…

Artificial Intelligence · Computer Science 2026-05-04 Mohd Sameen Chishti , Damilare Peter Oyinloye , Jingyue Li

As many of us in the information retrieval (IR) research community know and appreciate, search is far from being a solved problem. Millions of people struggle with tasks on search engines every day. Often, their struggles relate to the…

Information Retrieval · Computer Science 2024-04-04 Ryen W. White

Given the remarkable performance of Large Language Models (LLMs), an important question arises: Can LLMs conduct human-like scientific research and discover new knowledge, and act as an AI scientist? Scientific discovery is an iterative…

Machine Learning · Computer Science 2025-02-24 Tingting Chen , Srinivas Anumasa , Beibei Lin , Vedant Shah , Anirudh Goyal , Dianbo Liu

Generative AI agents, software systems powered by Large Language Models (LLMs), are emerging as a promising approach to automate cybersecurity tasks. Among the others, penetration testing is a challenging field due to the task complexity…

Cryptography and Security · Computer Science 2024-10-29 Luca Gioacchini , Marco Mellia , Idilio Drago , Alexander Delsanto , Giuseppe Siracusano , Roberto Bifulco

As reinforcement learning continues to scale the training of large language model-based agents, reliably verifying agent behaviors in complex environments has become increasingly challenging. Existing approaches rely on rule-based verifiers…

Artificial Intelligence · Computer Science 2026-04-21 Wentao Shi , Yu Wang , Yuyang Zhao , Yuxin Chen , Fuli Feng , Xueyuan Hao , Xi Su , Qi Gu , Hui Su , Xunliang Cai , Xiangnan He

Deep Research Agents are a prominent category of LLM-based agents. By autonomously orchestrating multistep web exploration, targeted retrieval, and higher-order synthesis, they transform vast amounts of online information into…

Computation and Language · Computer Science 2025-06-16 Mingxuan Du , Benfeng Xu , Chiwei Zhu , Xiaorui Wang , Zhendong Mao

Recent advances in agentic AI have enabled increasingly autonomous workflows, but existing systems still face substantial challenges in achieving reliable deployment in real-world scientific research. In this work, we present a safe,…

Artificial Intelligence · Computer Science 2026-04-16 Qibin Liu , Julia Gonski

Artificial intelligence systems for scientific discovery have demonstrated remarkable potential, yet existing approaches remain largely proprietary and operate in batch-processing modes requiring hours per research cycle, precluding…

Artificial Intelligence · Computer Science 2026-01-28 Lukas Weidener , Marko Brkić , Mihailo Jovanović , Ritvik Singh , Chiara Baccin , Emre Ulgac , Alex Dobrin , Aakaash Meduri

The impact of frontier AI (i.e., AI agents and foundation models) in cybersecurity is rapidly increasing. In this paper, we comprehensively analyze this trend through multiple aspects: quantitative benchmarks, qualitative literature review,…

Cryptography and Security · Computer Science 2025-12-01 Yujin Potter , Wenbo Guo , Zhun Wang , Tianneng Shi , Hongwei Li , Andy Zhang , Patrick Gage Kelley , Kurt Thomas , Dawn Song

As agentic AI systems increasingly operate autonomously, establishing trust through verifiable evaluation becomes critical. Yet existing benchmarks lack the transparency and auditability needed to assess whether agents behave reliably. We…

Computation and Language · Computer Science 2025-12-02 Hyunjun Kim , Sooyoung Ryu

AI policymakers are responsible for delivering effective governance mechanisms that can provide safe, aligned and trustworthy AI development. However, the information environment offered to policymakers is characterised by an unnecessarily…

Artificial Intelligence · Computer Science 2025-10-14 Israel Mason-Williams , Gabryel Mason-Williams

Poorly formulated research problems can compromise the practical relevance of Software Engineering studies by not reflecting the complexities of industrial practice. This vision paper explores the use of artificial intelligence agents to…

Software Engineering · Computer Science 2025-12-16 Anrafel Fernandes Pereira , Maria Teresa Baldassarre , Daniel Mendez , Marcos Kalinowski

Large language models (LLMs) are increasingly being used for complex research tasks such as literature review, idea generation, and scientific paper analysis, yet their ability to truly understand and process the intricate relationships…

Computation and Language · Computer Science 2025-06-11 Shashidhar Reddy Javaji , Yupeng Cao , Haohang Li , Yangyang Yu , Nikhil Muralidhar , Zining Zhu
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