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Although Large Language Models (LLMs) achieve remarkable performance across various tasks, they often struggle with complex reasoning tasks, such as answering mathematical questions. Recent efforts to address this issue have primarily…

Machine Learning · Computer Science 2024-06-27 Jikun Kang , Xin Zhe Li , Xi Chen , Amirreza Kazemi , Qianyi Sun , Boxing Chen , Dong Li , Xu He , Quan He , Feng Wen , Jianye Hao , Jun Yao

We introduce MLE-Dojo, a Gym-style framework for systematically reinforcement learning, evaluating, and improving autonomous large language model (LLM) agents in iterative machine learning engineering (MLE) workflows. Unlike existing…

Large Language Model (LLM)-based agents have recently shown impressive capabilities in complex reasoning and tool use via multi-step interactions with their environments. While these agents have the potential to tackle complicated tasks,…

Artificial Intelligence · Computer Science 2025-11-04 Jiaye Lin , Yifu Guo , Yuzhen Han , Sen Hu , Ziyi Ni , Licheng Wang , Mingguang Chen , Hongzhang Liu , Ronghao Chen , Yangfan He , Daxin Jiang , Binxing Jiao , Chen Hu , Huacan Wang

Automated feature engineering plays a critical role in improving predictive model performance for tabular learning tasks. Traditional automated feature engineering methods are limited by their reliance on pre-defined transformations within…

Machine Learning · Computer Science 2026-05-12 Nikhil Abhyankar , Parshin Shojaee , Chandan K. Reddy

While large language models (LLMs) have shown promise in automating data science, existing agents often struggle with the complexity of real-world workflows that require exploring multiple sources and synthesizing open-ended insights. In…

Artificial Intelligence · Computer Science 2026-02-25 Jaehyun Nam , Jinsung Yoon , Jiefeng Chen , Raj Sinha , Jinwoo Shin , Tomas Pfister

Reinforcement Learning (RL) has demonstrated significant potential in enhancing the reasoning capabilities of large language models (LLMs). However, the success of RL for LLMs heavily relies on human-curated datasets and verifiable rewards,…

Artificial Intelligence · Computer Science 2025-10-31 Yixing Chen , Yiding Wang , Siqi Zhu , Haofei Yu , Tao Feng , Muhan Zhang , Mostofa Patwary , Jiaxuan You

Large language models (LLMs) are catalyzing the development of autonomous AI research agents for scientific and engineering discovery. We present FM Agent, a novel and general-purpose multi-agent framework that leverages a synergistic…

Existing AutoML systems have advanced the automation of machine learning (ML); however, they still require substantial manual configuration and expert input, particularly when handling multimodal data. We introduce MLZero, a novel…

As comprehensive large model evaluation becomes prohibitively expensive, predicting model performance from limited observations has become essential. However, existing statistical methods struggle with pattern shifts, data sparsity, and…

Artificial Intelligence · Computer Science 2026-02-13 Xiaoxiao Wang , Chunxiao Li , Junying Wang , Yijin Guo , Zijian Chen , Chunyi Li , Xiaohong Liu , Zicheng Zhang , Guangtao Zhai

The proliferation of Large Language Models (LLMs) in recent years has realized many applications in various domains. Being trained with a huge of amount of data coming from various sources, LLMs can be deployed to solve different tasks,…

Software Engineering · Computer Science 2025-03-17 Duc S. H. Nguyen , Bach G. Truong , Phuong T. Nguyen , Juri Di Rocco , Davide Di Ruscio

The proliferation of Large Language Models (LLMs) in function calling is pivotal for creating advanced AI agents, yet their large scale hinders widespread adoption, necessitating transferring their capabilities into smaller ones. However,…

Artificial Intelligence · Computer Science 2026-02-25 Jiliang Ni , Jiachen Pu , Zhongyi Yang , Jingfeng Luo , Conggang Hu

While Large Language Models (LLMs) have empowered AI research agents to perform isolated scientific tasks, automating complex, real-world workflows, such as LLM training, remains a significant challenge. In this paper, we introduce TREX, a…

Artificial Intelligence · Computer Science 2026-04-23 Zerun Ma , Guoqiang Wang , Xinchen Xie , Yicheng Chen , He Du , Bowen Li , Yanan Sun , Wenran Liu , Kai Chen , Yining Li

Ensembling large language models (LLMs) can effectively combine diverse strengths of different models, offering a promising approach to enhance performance across various tasks. However, existing methods typically rely on fixed weighting…

Machine Learning · Computer Science 2025-06-03 Yuqian Fu , Yuanheng Zhu , Jiajun Chai , Guojun Yin , Wei Lin , Qichao Zhang , Dongbin Zhao

Context: Large Language Model (LLM) agents are becoming widely used for various Requirements Engineering (RE) tasks. Research on improving their accuracy mainly focuses on prompt engineering, model fine-tuning, and retrieval augmented…

Software Engineering · Computer Science 2025-11-20 Marc Oriol , Quim Motger , Jordi Marco , Xavier Franch

Conventional mechanical design follows an iterative process in which initial concepts are refined through cycles of expert assessment and resource-intensive Finite Element Method (FEM) analysis to meet performance goals. While machine…

Machine Learning · Computer Science 2025-05-02 Yayati Jadhav , Amir Barati Farimani

Monitoring Machine Learning (ML) models in production environments is crucial, yet traditional approaches often yield verbose, low-interpretability outputs that hinder effective decision-making. We propose a cognitive architecture for ML…

Machine Learning · Computer Science 2025-06-12 Gusseppe Bravo-Rocca , Peini Liu , Jordi Guitart , Rodrigo M Carrillo-Larco , Ajay Dholakia , David Ellison

Large Language Model (LLM)-based agents demonstrate advanced reasoning capabilities, yet practical constraints frequently limit outputs to single responses, leaving significant performance potential unrealized. This paper introduces MARINE…

Multiagent Systems · Computer Science 2025-12-10 Hongwei Zhang , Ji Lu , Yongsheng Du , Yanqin Gao , Lingjun Huang , Baoli Wang , Fang Tan , Peng Zou

Autonomous agents, which perceive environments and take actions to achieve goals, have become increasingly feasible with the advancements in large language models (LLMs). However, current powerful agents often depend on sophisticated prompt…

Computation and Language · Computer Science 2025-05-27 Yihan Chen , Benfeng Xu , Xiaorui Wang , Yongdong Zhang , Zhendong Mao

Existing large language models (LLMs) show exceptional problem-solving capabilities but might struggle with complex reasoning tasks. Despite the successes of chain-of-thought and tree-based search methods, they mainly depend on the internal…

Computation and Language · Computer Science 2024-12-18 Jinhao Jiang , Jiayi Chen , Junyi Li , Ruiyang Ren , Shijie Wang , Wayne Xin Zhao , Yang Song , Tao Zhang

Existing agents for solving tasks such as ML engineering rely on prompting powerful language models. As a result, these agents do not improve with more experience. In this paper, we show that agents backed by weaker models that improve via…

Machine Learning · Computer Science 2025-09-04 Sherry Yang , Joy He-Yueya , Percy Liang