Efficient Heuristics Generation for Solving Combinatorial Optimization Problems Using Large Language Models (2505.12627v2)

Abstract: Recent studies exploited LLMs to autonomously generate heuristics for solving Combinatorial Optimization Problems (COPs), by prompting LLMs to first provide search directions and then derive heuristics accordingly. However, the absence of task-specific knowledge in prompts often leads LLMs to provide unspecific search directions, obstructing the derivation of well-performing heuristics. Moreover, evaluating the derived heuristics remains resource-intensive, especially for those semantically equivalent ones, often requiring omissible resource expenditure. To enable LLMs to provide specific search directions, we propose the Hercules algorithm, which leverages our designed Core Abstraction Prompting (CAP) method to abstract the core components from elite heuristics and incorporate them as prior knowledge in prompts. We theoretically prove the effectiveness of CAP in reducing unspecificity and provide empirical results in this work. To reduce computing resources required for evaluating the derived heuristics, we propose few-shot Performance Prediction Prompting (PPP), a first-of-its-kind method for the Heuristic Generation (HG) task. PPP leverages LLMs to predict the fitness values of newly derived heuristics by analyzing their semantic similarity to previously evaluated ones. We further develop two tailored mechanisms for PPP to enhance predictive accuracy and determine unreliable predictions, respectively. The use of PPP makes Hercules more resource-efficient and we name this variant Hercules-P. Extensive experiments across four HG tasks, five COPs, and eight LLMs demonstrate that Hercules outperforms the state-of-the-art LLM-based HG algorithms, while Hercules-P excels at minimizing required computing resources. In addition, we illustrate the effectiveness of CAP, PPP, and the other proposed mechanisms by conducting relevant ablation studies.