SELA: Tree-Search Enhanced LLM Agents for Automated Machine Learning

Authors: Yizhou Chi, Yizhang Lin, Sirui Hong, Duyi Pan, Yaying Fei, Guanghao Mei, Bangbang Liu, Tianqi Pang, Jacky Kwok, Ceyao Zhang, Bang Liu, Chenglin Wu

Abstract: Automated Machine Learning (AutoML) approaches encompass traditional methods
that optimize fixed pipelines for model selection and ensembling, as well as
newer LLM-based frameworks that autonomously build pipelines. While LLM-based
agents have shown promise in automating machine learning tasks, they often
generate low-diversity and suboptimal code, even after multiple iterations. To
overcome these limitations, we introduce Tree-Search Enhanced LLM Agents
(SELA), an innovative agent-based system that leverages Monte Carlo Tree Search
(MCTS) to optimize the AutoML process. By representing pipeline configurations
as trees, our framework enables agents to conduct experiments intelligently and
iteratively refine their strategies, facilitating a more effective exploration
of the machine learning solution space. This novel approach allows SELA to
discover optimal pathways based on experimental feedback, improving the overall
quality of the solutions. In an extensive evaluation across 20 machine learning
datasets, we compare the performance of traditional and agent-based AutoML
methods, demonstrating that SELA achieves a win rate of 65% to 80% against each
baseline across all datasets. These results underscore the significant
potential of agent-based strategies in AutoML, offering a fresh perspective on
tackling complex machine learning challenges.

Source: http://arxiv.org/abs/2410.17238v1

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