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Automated scientific discovery promises to accelerate progress across scientific domains. However, developing and evaluating an AI agent's capacity for end-to-end scientific reasoning is challenging as running real-world experiments is…

Test-time scaling (TTS) has become an effective approach for improving large language model performance by allocating additional computation during inference. However, existing TTS strategies are largely hand-crafted: researchers manually…

Computation and Language · Computer Science 2026-05-13 Tong Zheng , Haolin Liu , Chengsong Huang , Huiwen Bao , Sheng Zhang , Rui Liu , Runpeng Dai , Ruibo Chen , Chenxi Liu , Tianyi Xiong , Xidong Wu , Hongming Zhang , Heng Huang

As large language models (LLMs) advance their mathematical capabilities toward the IMO level, the scarcity of challenging, high-quality problems for training and evaluation has become a significant bottleneck. Simultaneously, recent code…

Computation and Language · Computer Science 2026-03-05 Dadi Guo , Yuejin Xie , Qingyu Liu , Jiayu Liu , Zhiyuan Fan , Qihan Ren , Shuai Shao , Tianyi Zhou , Dongrui Liu , Yi R. Fung

The applications of large language models (LLMs) have been widely spread across all domains. However, the basic abilities such as the controllability of LLMs are still limited. To address this, we propose "Self-controller", a novel agentic…

Computation and Language · Computer Science 2024-10-02 Xiao Peng , Xufan Geng

Reinforcement learning (RL) has demonstrated potential in enhancing the reasoning capabilities of large language models (LLMs), but such training typically demands substantial efforts in creating and annotating data. In this work, we…

Computation and Language · Computer Science 2025-10-06 Hangfan Zhang , Siyuan Xu , Zhimeng Guo , Huaisheng Zhu , Shicheng Liu , Xinrun Wang , Qiaosheng Zhang , Yang Chen , Peng Ye , Lei Bai , Shuyue Hu

Recent advancements in Large Language Models (LLMs) have spurred interest in deploying LLM agents to undertake tasks in the world. LLMs are often deployed in agent systems: code that orchestrates LLM calls and provides them with tools. We…

Artificial Intelligence · Computer Science 2025-05-20 Maxime Robeyns , Martin Szummer , Laurence Aitchison

Recent advances in deep-research systems have demonstrated the potential for AI agents to autonomously discover and synthesize knowledge from external sources. In this paper, we introduce WebResearcher, a novel framework for building such…

In recent developments within the research community, the integration of Large Language Models (LLMs) in creating fully autonomous agents has garnered significant interest. Despite this, LLM-based agents frequently demonstrate notable…

Computation and Language · Computer Science 2024-02-21 Xueyang Feng , Zhi-Yuan Chen , Yujia Qin , Yankai Lin , Xu Chen , Zhiyuan Liu , Ji-Rong Wen

Statistical model discovery is a challenging search over a vast space of models subject to domain-specific constraints. Efficiently searching over this space requires expertise in modeling and the problem domain. Motivated by the domain…

Machine Learning · Computer Science 2024-06-25 Michael Y. Li , Emily B. Fox , Noah D. Goodman

We show that multi-agent systems guided by vision-language models (VLMs) improve end-to-end autonomous scientific discovery. By treating plots as verifiable checkpoints, a VLM-as-a-judge evaluates figures against dynamically generated…

Computation and Language · Computer Science 2025-11-19 Kahaan Gandhi , Boris Bolliet , Inigo Zubeldia

Scientific algorithm discovery is iterative: hypotheses are proposed, implemented, stress-tested, and revised. Current LLM-guided search systems accelerate proposal generation, but often under-represent scientific structure by optimizing…

Machine Learning · Computer Science 2026-04-02 Youssef Mroueh , Carlos Fonseca , Brian Belgodere , David Cox

Recent progress in autonomous code generation has fueled excitement around AI agents capable of accelerating scientific discovery by running experiments. However, there is currently no benchmark that evaluates whether such agents can…

Artificial Intelligence · Computer Science 2025-06-25 Gyeongwon James Kim , Alex Wilf , Louis-Philippe Morency , Daniel Fried

Large Language Models (LLMs) have significantly enhanced Information Retrieval (IR) across various modules, such as reranking. Despite impressive performance, current zero-shot relevance ranking with LLMs heavily relies on human prompt…

Artificial Intelligence · Computer Science 2025-05-21 Can Jin , Hongwu Peng , Shiyu Zhao , Zhenting Wang , Wujiang Xu , Ligong Han , Jiahui Zhao , Kai Zhong , Sanguthevar Rajasekaran , Dimitris N. Metaxas

Designing effective auxiliary rewards for cooperative multi-agent systems remains challenging, as misaligned incentives can induce suboptimal coordination, particularly when sparse task rewards provide insufficient grounding for coordinated…

Machine Learning · Computer Science 2026-04-07 Dogan Urgun , Gokhan Gungor

Automated heuristic design (AHD) has gained considerable attention for its potential to automate the development of effective heuristics. The recent advent of large language models (LLMs) has paved a new avenue for AHD, with initial efforts…

Neural and Evolutionary Computing · Computer Science 2024-07-16 Rui Zhang , Fei Liu , Xi Lin , Zhenkun Wang , Zhichao Lu , Qingfu Zhang

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

With the advance of large language models (LLMs), the research field of LLM applications becomes more and more popular and the idea of constructing pipelines to accomplish complex tasks by stacking LLM API calls come true. However, this…

Computation and Language · Computer Science 2023-10-20 Hao Sun , Xiao Liu , Yeyun Gong , Yan Zhang , Daxin Jiang , Linjun Yang , Nan Duan

We introduce AlphaRank, an artificial intelligence approach to address the fixed-budget ranking and selection (R&S) problems. We formulate the sequential sampling decision as a Markov decision process and propose a Monte Carlo…

Machine Learning · Computer Science 2024-02-05 Ruihan Zhou , L. Jeff Hong , Yijie Peng

Reasoning-augmented search agents such as Search-R1, trained via reinforcement learning with verifiable rewards (RLVR), demonstrate remarkable capabilities in multi-step information retrieval from external knowledge sources. These agents…

Computation and Language · Computer Science 2025-08-14 Shu Zhao , Tan Yu , Anbang Xu , Japinder Singh , Aaditya Shukla , Rama Akkiraju

Chain-of-thought prompting significantly boosts the reasoning ability of large language models but still faces three issues: hallucination problem, restricted interpretability, and uncontrollable generation. To address these challenges, we…

Computation and Language · Computer Science 2024-09-20 Chen Liang , Zhifan Feng , Zihe Liu , Wenbin Jiang , Jinan Xu , Yufeng Chen , Yong Wang
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