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The emergence of large language model (LLM)-based agents has significantly advanced the development of autonomous machine learning (ML) engineering. However, the dominant prompt-based paradigm exhibits limitations: smaller models lack the…

Computation and Language · Computer Science 2026-05-04 Zexi Liu , Jingyi Chai , Xinyu Zhu , Shuo Tang , Rui Ye , Bo Zhang , Lei Bai , Siheng Chen

Agentic systems powered by Large Language Models (LLMs) have demonstrated remarkable potential in tackling complex, long-horizon tasks. However, their efficacy is fundamentally constrained by static configurations governing agent behaviors,…

Artificial Intelligence · Computer Science 2026-02-24 Jingqi Zhou , Sheng Wang , DeZhao Deng , Junwen Lu , Junwei Su , Qintong Li , Jiahui Gao , Hao Wu , Jiyue Jiang , Lingpeng Kong , Chuan Wu

Large language model agents are becoming increasingly capable at web-centric tasks such as information retrieval, complex reasoning. These emerging capabilities have given rise to surge research interests in developing LLM agent for…

Computation and Language · Computer Science 2026-04-02 Yu Li , Lehui Li , Lin Chen , Qingmin Liao , Fengli Xu , Yong Li

Large language models (LLMs) integrated with autonomous agents hold significant potential for advancing scientific discovery through automated reasoning and task execution. However, applying LLM agents to drug discovery is still constrained…

Artificial Intelligence · Computer Science 2025-07-29 Kun Li , Zhennan Wu , Shoupeng Wang , Jia Wu , Shirui Pan , Wenbin Hu

Effective tool use is essential for agentic AI, yet training agents to utilize tools remains challenging due to manually designed rewards, limited training data, and poor multi-tool selection, resulting in slow adaptation, wasted…

Artificial Intelligence · Computer Science 2026-01-13 Quy Minh Le , Minh Sao Khue Luu , Khanh-Tung Tran , Duc-Hai Nguyen , Hoang-Quoc-Viet Pham , Quan Le , Hoang Thanh Lam , Hoang D. Nguyen

Agentic multimodal models should not only comprehend text and images, but also actively invoke external tools, such as code execution environments and web search, and integrate these operations into reasoning. In this work, we introduce…

Computer Vision and Pattern Recognition · Computer Science 2026-03-12 Jack Hong , Chenxiao Zhao , ChengLin Zhu , Weiheng Lu , Guohai Xu , Xing Yu

Recently, the emergence of agentic RL has showcased that RL could also effectively improve the agentic reasoning ability of LLMs, yet the key design principles and optimal practices remain unclear. In this work, we conduct a comprehensive…

Computation and Language · Computer Science 2025-10-14 Zhaochen Yu , Ling Yang , Jiaru Zou , Shuicheng Yan , Mengdi Wang

Recently, large language models (LLMs) have shown remarkable reasoning capabilities via large-scale reinforcement learning (RL). However, leveraging the RL algorithm to empower effective multi-tool collaborative reasoning in LLMs remains an…

Computation and Language · Computer Science 2025-05-23 Guanting Dong , Yifei Chen , Xiaoxi Li , Jiajie Jin , Hongjin Qian , Yutao Zhu , Hangyu Mao , Guorui Zhou , Zhicheng Dou , Ji-Rong Wen

Tool learning is increasingly important for large language models (LLMs) to effectively coordinate and utilize a diverse set of tools in order to solve complex real-world tasks. By selecting and integrating appropriate tools, LLMs extend…

Machine Learning · Computer Science 2026-01-21 Zheng Fang , Wolfgang Mayer , Zeyu Zhang , Jian Wang , Hong-Yu Zhang , Wanli Li , Zaiwen Feng

Agentic AI enables LLM to dynamically reason, plan, and interact with tools to solve complex tasks. However, agentic workflows often require many iterative reasoning steps and tool invocations, leading to significant operational expense,…

Artificial Intelligence · Computer Science 2026-02-03 Sami Abuzakuk , Anne-Marie Kermarrec , Rishi Sharma , Rasmus Moorits Veski , Martijn de Vos

How should an agent decide when and how to plan? A dominant approach builds agents as reactive policies with adaptive computation (e.g., chain-of-thought), trained end-to-end expecting planning to emerge implicitly. Without control over the…

Artificial Intelligence · Computer Science 2026-05-22 Mingkai Deng , Jinyu Hou , Lara Sá Neves , Varad Pimpalkhute , Taylor W. Killian , Zhengzhong Liu , Eric P. Xing

Recent progress in large language models (LLMs) has been propelled by reinforcement learning with verifiable rewards (RLVR) and test-time scaling. However, the limited output length of LLMs constrains the depth of reasoning attainable in a…

Artificial Intelligence · Computer Science 2025-11-17 Shulin Liu , Dong Du , Tao Yang , Yang Li , Boyu Qiu

Retrieval-Augmented Generation (RAG) has emerged as a powerful framework to overcome the knowledge limitations of Large Language Models (LLMs) by integrating external retrieval with language generation. While early RAG systems based on…

Artificial Intelligence · Computer Science 2025-06-13 Jintao Liang , Gang Su , Huifeng Lin , You Wu , Rui Zhao , Ziyue Li

Large Language Models (LLMs) equipped with external tools have demonstrated enhanced performance on complex reasoning tasks. The widespread adoption of this tool-augmented reasoning is hindered by the scarcity of domain-specific tools. For…

Computation and Language · Computer Science 2025-10-10 Murong Yue , Zhiwei Liu , Liangwei Yang , Jianguo Zhang , Zuxin Liu , Haolin Chen , Ziyu Yao , Silvio Savarese , Caiming Xiong , Shelby Heinecke , Huan Wang

Large language models (LLMs) are increasingly integrated into recommender systems, motivating recent interest in agentic and reasoning-based recommendation. However, most existing approaches still rely on fixed workflows, applying the same…

Information Retrieval · Computer Science 2026-02-12 Fuchun Li , Qian Li , Xingyu Gao , Bocheng Pan , Yang Wu , Jun Zhang , Huan Yu , Jie Jiang , Jinsheng Xiao , Hailong Shi

Vision-language agents have achieved remarkable progress in a variety of multimodal reasoning tasks; however, their learning remains constrained by the limitations of human-annotated supervision. Recent self-rewarding approaches attempt to…

Computer Vision and Pattern Recognition · Computer Science 2025-11-27 Jiaqi Liu , Kaiwen Xiong , Peng Xia , Yiyang Zhou , Haonian Ji , Lu Feng , Siwei Han , Mingyu Ding , Huaxiu Yao

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

Reinforcement Learning (RL) has traditionally focused on training specialized agents to optimize predefined reward functions within narrowly defined environments. However, the advent of powerful Large Language Models (LLMs) and increasingly…

Artificial Intelligence · Computer Science 2026-05-18 Fangming Cui , Ruixiao Zhu , Cheng Fang , Sunan Li , Jiahong Li

Tool-Integrated Reasoning (TIR) has significantly enhanced the capabilities of Large Language Models (LLMs), yet current agents tend to exhibit cognitive offloading, redundantly invoking external tools even for simple tasks. In this paper,…

Computation and Language · Computer Science 2026-01-22 Zhaiyu Fang , Ruipeng Sun

Large language models (LLMs) can perform complex reasoning in few- and zero-shot settings by generating intermediate chain of thought (CoT) reasoning steps. Further, each reasoning step can rely on external tools to support computation…

Computation and Language · Computer Science 2023-03-17 Bhargavi Paranjape , Scott Lundberg , Sameer Singh , Hannaneh Hajishirzi , Luke Zettlemoyer , Marco Tulio Ribeiro