LLM-Meta-SR: Learning to Evolve Selection Operators for Symbolic Regression

Hengzhe Zhang, Qi Chen, Bing Xue, Mengjie Zhang

Abstract: Large language models (LLMs) have revolutionized algorithm development, yet their application in symbolic regression, where algorithms automatically discover symbolic expressions from data, remains constrained and is typically designed manually by human experts. In this paper, we propose a meta learning framework that enables LLMs to automatically design selection operators for evolutionary symbolic regression algorithms. We first identify two key limitations in existing LLM-based algorithm evolution techniques: a lack of semantic guidance and code bloat. The absence of semantic awareness can lead to ineffective exchange of useful code components, and bloat results in unnecessarily complex components, both of which can reduce the interpretability of the designed algorithm or hinder evolutionary learning progress. To address these issues, we enhance the LLM-based evolution framework for meta symbolic regression with two key innovations: a complementary, semantics-aware selection operator and bloat control. Additionally, we embed domain knowledge into the prompt, enabling the LLM to generate more effective and contextually relevant selection operators. Our experimental results on symbolic regression benchmarks show that LLMs can devise selection operators that outperform nine expert-designed baselines, achieving state-of-the-art performance. Moreover, the evolved operator can further improve the state-of-the-art symbolic regression algorithm, achieving the best performance among 26 symbolic regression and machine learning algorithms across 116 regression datasets. This demonstrates that LLMs can exceed expert-level algorithm design for symbolic regression.

External IDs:dblp:journals/corr/abs-2505-18602