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For agentic systems to use external tools to solve complex, long-horizon tasks, we need a large set of diverse and controllable tool-use environments. We introduce SynthTools, a fully LLM-based pipeline spanning the entire lifecycle:…

Artificial Intelligence · Computer Science 2026-05-28 Tommaso Castellani , Naimeng Ye , Daksh Mittal , Thomson Yen , Emmanouil Koukoumidis , William Zeng , Hongseok Namkoong

In this thesis, we develop algorithms with theoretical guarantees for ensuring reliability and accountability of Machine Learning (ML) systems. As ML systems evolve from predictive models to generative models and autonomous agents, the…

Machine Learning · Computer Science 2026-05-12 Carol Xuan Long

Evaluating Large Language Models (LLMs) is one of the most critical aspects of building a performant compound AI system. Since the output from LLMs propagate to downstream steps, identifying LLM errors is crucial to system performance. A…

Tool-calling agents are increasingly deployed in real-world customer-facing workflows. Yet most studies on tool-calling agents focus on idealized settings with general, fixed, and well-specified tasks. In real-world applications, user…

Computation and Language · Computer Science 2026-04-23 Ziyi Wang , Yuxuan Lu , Yimeng Zhang , Pei Chen , Ziwei Dong , Jing Huang , Jiri Gesi , Xianfeng Tang , Chen Luo , Qun Liu , Yisi Sang , Hanqing Lu , Manling Li , Jin Lai , Dakuo Wang

Skills, i.e., structured workflow instructions distilled for large language models (LLMs), are becoming an increasingly important mechanism for improving agent performance on real-world downstream tasks. However, as the open-source skill…

Computation and Language · Computer Science 2026-05-29 Jiahao Ying , Boxian Ai , Wei Tang , Siyuan Liu , Yixin Cao

Modern Large Language Models (LLMs) often require external tools, such as machine learning classifiers or knowledge retrieval systems, to provide accurate answers in domains where their pre-trained knowledge is insufficient. This…

Machine Learning · Computer Science 2025-05-23 Panagiotis Lymperopoulos , Vasanth Sarathy

AI agents are autonomous systems that combine LLMs with external tools to solve complex tasks. While such tools extend capability, improper tool permissions introduce security risks such as indirect prompt injection and tool misuse. We…

Cryptography and Security · Computer Science 2026-01-21 Roy Betser , Shamik Bose , Amit Giloni , Chiara Picardi , Sindhu Padakandla , Roman Vainshtein

Software is one of the most powerful tools that we humans have at our disposal; it allows a skilled programmer to interact with the world in complex and profound ways. At the same time, thanks to improvements in large language models…

As AI agents move from demos into enterprise deployments, their failure modes become consequential: a misinterpreted tool argument can corrupt production data, a silent reasoning error can go undetected until damage is done, and outputs…

As LLM-based applications reach millions of customers, ensuring their scalability and continuous quality improvement is critical for success. However, the current workflows for developing, maintaining, and operating (DevOps) these…

LLM-based coding agents are increasingly used to generate code, tests, and documentation. Still, their outputs can be plausible yet misaligned with developer intent and provide limited evidence for review in evolving projects. This limits…

Software Engineering · Computer Science 2026-04-14 Ragib Shahariar Ayon

With ChatGPT-like large language models (LLM) prevailing in the community, how to evaluate the ability of LLMs is an open question. Existing evaluation methods suffer from following shortcomings: (1) constrained evaluation abilities, (2)…

Artificial Intelligence · Computer Science 2023-08-09 Jiaju Lin , Haoran Zhao , Aochi Zhang , Yiting Wu , Huqiuyue Ping , Qin Chen

Significant focus has been placed on integrating large language models (LLMs) with various tools in developing general-purpose agents. This poses a challenge to LLMs' tool-use capabilities. However, there are evident gaps between existing…

Computation and Language · Computer Science 2024-11-25 Jize Wang , Zerun Ma , Yining Li , Songyang Zhang , Cailian Chen , Kai Chen , Xinyi Le

Large Language Models (LLMs) excel in traditional natural language processing tasks but struggle with problems that require complex domain-specific calculations or simulations. While equipping LLMs with external tools to build LLM-based…

Software Engineering · Computer Science 2025-06-11 Bohan Lyu , Xin Cong , Heyang Yu , Pan Yang , Yujia Qin , Yining Ye , Yaxi Lu , Zhong Zhang , Yukun Yan , Yankai Lin , Zhiyuan Liu , Maosong Sun

Large language models (LLMs) have displayed massive improvements in reasoning and decision-making skills and can hold natural conversations with users. Many recent works seek to augment LLM-based assistants with external tools so they can…

Computation and Language · Computer Science 2023-11-21 Nicholas Farn , Richard Shin

Despite the remarkable progress of large language models (LLMs), the capabilities of standalone LLMs have begun to plateau when tackling real-world, complex tasks that require interaction with external tools and dynamic environments.…

Recent advancements in tool-augmented large language models have enabled them to interact with external tools, enhancing their ability to perform complex user tasks. However, existing approaches overlook the role of personalisation in…

Computation and Language · Computer Science 2025-09-17 Ekaterina Taktasheva , Jeff Dalton

Autonomous agents based on large language models (LLMs) are rapidly emerging as a general-purpose technology, with recent systems such as OpenClaw extending their capabilities through broad tool use, third-party skills, and deeper…

Cryptography and Security · Computer Science 2026-05-15 Lukas Pirch , Micha Horlboge , Patrick Großmann , Syeda Mahnur Asif , Klim Kireev , Thorsten Holz , Konrad Rieck

As AI agents built on large language models (LLMs) become increasingly embedded in society, issues of coordination, control, delegation, and accountability are entangled with concerns over their reliability. To design and implement LLM…

Computers and Society · Computer Science 2025-12-09 R. Patrick Xian , Garry A. Gabison , Ahmed Alaa , Christoph Riedl , Grigorios G. Chrysos

Reliability is key to realizing the promise of autonomous UI-Agents, multimodal agents that directly interact with apps in the same manner as humans, as users must be able to trust an agent to complete a given task. Current evaluations rely…