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AI agents hold the potential to revolutionize scientific productivity by automating literature reviews, replicating experiments, analyzing data, and even proposing new directions of inquiry; indeed, there are now many such agents, ranging…

As large language models (LLMs) advance, their inability to autonomously execute tasks by directly interacting with external tools remains a critical limitation. Traditional methods rely on inputting tool descriptions as context, which is…

Computation and Language · Computer Science 2025-04-01 Renxi Wang , Xudong Han , Lei Ji , Shu Wang , Timothy Baldwin , Haonan Li

LLM-powered tool-calling agents fulfill user requests by interacting with environments, querying data, and invoking tools in a multi-turn process. Yet, most existing benchmarks evaluate these systems under static environment interfaces,…

Reasoning about time is essential for Large Language Models (LLMs) to understand the world. Previous works focus on solving specific tasks, primarily on time-sensitive question answering. While these methods have proven effective, they…

Computation and Language · Computer Science 2024-08-20 Zhaochen Su , Jun Zhang , Tong Zhu , Xiaoye Qu , Juntao Li , Min Zhang , Yu Cheng

As large language models (LLMs) increasingly tackle complex reasoning tasks, test-time scaling has become critical for enhancing capabilities. However, in agentic scenarios with frequent tool calls, the traditional generation-length-based…

Computation and Language · Computer Science 2026-01-26 Yichuan Ma , Linyang Li , Yongkang chen , Peiji Li , Xiaozhe Li , Qipeng Guo , Dahua Lin , Kai Chen

Large language models (LLMs) have shown strong capabilities in complex reasoning, and test-time scaling techniques can enhance their performance with comparably low cost. Many of these methods have been developed and evaluated on…

Scientific Large Language Models (Sci-LLMs) are transforming how knowledge is represented, integrated, and applied in scientific research, yet their progress is shaped by the complex nature of scientific data. This survey presents a…

Computation and Language · Computer Science 2025-10-21 Ming Hu , Chenglong Ma , Wei Li , Wanghan Xu , Jiamin Wu , Jucheng Hu , Tianbin Li , Guohang Zhuang , Jiaqi Liu , Yingzhou Lu , Ying Chen , Chaoyang Zhang , Cheng Tan , Jie Ying , Guocheng Wu , Shujian Gao , Pengcheng Chen , Jiashi Lin , Haitao Wu , Lulu Chen , Fengxiang Wang , Yuanyuan Zhang , Xiangyu Zhao , Feilong Tang , Encheng Su , Junzhi Ning , Xinyao Liu , Ye Du , Changkai Ji , Pengfei Jiang , Cheng Tang , Ziyan Huang , Jiyao Liu , Jiaqi Wei , Yuejin Yang , Xiang Zhang , Guangshuai Wang , Yue Yang , Huihui Xu , Ziyang Chen , Yizhou Wang , Chen Tang , Jianyu Wu , Yuchen Ren , Siyuan Yan , Zhonghua Wang , Zhongxing Xu , Shiyan Su , Shangquan Sun , Runkai Zhao , Zhisheng Zhang , Dingkang Yang , Jinjie Wei , Jiaqi Wang , Jiahao Xu , Jiangtao Yan , Wenhao Tang , Hongze Zhu , Yu Liu , Fudi Wang , Yiqing Shen , Yuanfeng Ji , Yanzhou Su , Tong Xie , Hongming Shan , Chun-Mei Feng , Zhi Hou , Diping Song , Lihao Liu , Yanyan Huang , Lequan Yu , Bin Fu , Shujun Wang , Xiaomeng Li , Xiaowei Hu , Yun Gu , Ben Fei , Benyou Wang , Yuewen Cao , Minjie Shen , Jie Xu , Haodong Duan , Fang Yan , Hongxia Hao , Jielan Li , Jiajun Du , Yanbo Wang , Imran Razzak , Zhongying Deng , Chi Zhang , Lijun Wu , Conghui He , Zhaohui Lu , Jinhai Huang , Wenqi Shao , Yihao Liu , Siqi Luo , Yi Xin , Xiaohong Liu , Fenghua Ling , Yuqiang Li , Aoran Wang , Siqi Sun , Qihao Zheng , Nanqing Dong , Tianfan Fu , Dongzhan Zhou , Yan Lu , Wenlong Zhang , Jin Ye , Jianfei Cai , Yirong Chen , Wanli Ouyang , Yu Qiao , Zongyuan Ge , Shixiang Tang , Junjun He , Chunfeng Song , Lei Bai , Bowen Zhou

Tool use has turned large language models (LLMs) into powerful agents that can perform complex multi-step tasks by dynamically utilising external software components. However, these tools must be implemented in advance by human developers,…

Computation and Language · Computer Science 2025-06-02 Georg Wölflein , Dyke Ferber , Daniel Truhn , Ognjen Arandjelović , Jakob Nikolas Kather

We introduce Learning to Self-Evolve (LSE), a reinforcement learning framework that trains large language models (LLMs) to improve their own contexts at test time. We situate LSE in the setting of test-time self-evolution, where a model…

Computation and Language · Computer Science 2026-03-20 Xiaoyin Chen , Canwen Xu , Yite Wang , Boyi Liu , Zhewei Yao , Yuxiong He

Time functions as a fundamental dimension of human cognition, yet the mechanisms by which Large Language Models (LLMs) encode chronological progression remain opaque. We demonstrate that temporal information in their latent space is…

Computation and Language · Computer Science 2026-01-13 Jingmin An , Wei Liu , Qian Wang , Fang Fang

An important recurring pattern in scientific breakthroughs is a two-stage process: an initial phase of undirected experimentation that yields an unexpected finding, followed by a retrospective phase that explains why the finding works and…

Artificial Intelligence · Computer Science 2026-04-08 Zhe Zhao , Haibin Wen , Jiaming Ma , Jiachang Zhan , Tianyi Xu , Ye Wei , Qingfu Zhang

As modern science becomes increasingly data-intensive, the ability to analyze and visualize large-scale, complex datasets is critical to accelerating discovery. However, many domain scientists lack the programming expertise required to…

Software Engineering · Computer Science 2025-12-01 Apu Kumar Chakroborti , Yi Ding , Lipeng Wan

Large Language Models (LLMs) are widely used as judges to evaluate response quality, providing a scalable alternative to human evaluation. However, most LLM judges operate solely on intrinsic text-based reasoning, limiting their ability to…

Computation and Language · Computer Science 2026-02-24 Ran Xu , Jingjing Chen , Jiayu Ye , Yu Wu , Jun Yan , Carl Yang , Hongkun Yu

Large language models (LLMs) are increasingly used in scientific domains. While they can produce reasoning-like content via methods such as chain-of-thought prompting, these outputs are typically unstructured and informal, obscuring whether…

Artificial Intelligence · Computer Science 2025-11-18 Pengze Li , Jiaqi Liu , Junchi Yu , Lihao Liu , Mingyu Ding , Wanli Ouyang , Shixiang Tang , Xi Chen

Recent advances have established a new machine learning paradigm based on scaling up compute at inference time as well as at training time. In that line of work, a combination of Supervised Fine-Tuning (SFT) on synthetic demonstrations and…

Machine Learning · Computer Science 2025-07-08 Corrado Rainone , Tim Bakker , Roland Memisevic

LLM-based evolution has emerged as a promising way to improve agents by refining non-parametric artifacts, but its wall-clock cost remains a major bottleneck. We identify that this cost comes from synchronized stage execution and imbalance…

Machine Learning · Computer Science 2026-05-12 Zhengding Hu , Mingge Lu , Zhen Wang , Jixuan Ruan , Chang Chen , Zaifeng Pan , Yue Guan , Ruiyi Wang , Zhongkai Yu , Chao Zhang , Yufei Ding

Tools are essential for large language models (LLMs) to acquire up-to-date information and take consequential actions in external environments. Existing work on tool-augmented LLMs primarily focuses on the broad coverage of tools and the…

Computation and Language · Computer Science 2024-03-08 Boshi Wang , Hao Fang , Jason Eisner , Benjamin Van Durme , Yu Su

The discovery of symbolic solutions -- mathematical expressions, logical rules, and algorithmic structures -- is fundamental to advancing scientific and engineering progress. However, traditional methods often struggle with search…

Artificial Intelligence · Computer Science 2025-11-17 Ping Guo , Qingfu Zhang , Xi Lin

Mathematical reasoning is an important research direction in the field of artificial intelligence. This article proposes a novel multi tool application framework for mathematical reasoning, aiming to achieve more comprehensive and accurate…

Artificial Intelligence · Computer Science 2024-08-23 Zhihua Duan , Jialin Wang

Recent advances in large language models (LLMs) have enabled breakthroughs in mathematical discovery, exemplified by AlphaEvolve, a closed-source system that evolves programs to improve bounds on open problems. However, it relies on…