Enhancing CVRP Solver through LLM-driven Automatic Heuristic Design

Solving large-scale CVRP (LSCVRP) with hundreds to thousands of nodes remains difficult for even state-of-the-art solvers. Divide-and-conquer can scale by decomposing the instance into size-reduced subproblems, but designing decomposition logic and configuring sub-solvers is highly expertise- and labor-intensive. Large Language Models (LLMs) have emerged as promising tools for automated algorithm design. However, existing LLM-driven approaches struggle with LSCVRP primarily due to the difficulty in generating sophisticated search strategies within a limited context window. To bridge this gap, we propose the LLM-assisted Flexible Monte Carlo Tree Search (LaF-MCTS), a novel framework that automates the design of high-performance LSCVRP solvers. We develop a three-tier decision hierarchy to enable incremental design of decomposition policies and sub-solvers for LSCVRP. To enable efficient search within the algorithmic hypothesis space, we introduce semantic pruning to eliminate semantically and structurally redundant codes, and branch regrowth to regenerate codes and preserve diversity. Extensive experiments on CVRPLib demonstrate that LaF-MCTS autonomously composes and optimizes decomposition-enhanced solvers that surpasses various state-of-the-art CVRP solvers.

Designing high-performing metaheuristics for NP-hard combinatorial optimization problems, such as the Vehicle Routing Problem (VRP), remains a significant challenge, often requiring extensive domain expertise and manual tuning. Recent advances have demonstrated the potential of large language models (LLMs) to automate this process through evolutionary search. However, existing methods are largely reactive, relying on immediate performance feedback to guide what are essentially black-box code mutations. Our work departs from this paradigm by introducing Metacognitive Evolutionary Programming (MEP), a framework that elevates the LLM to a strategic discovery agent. Instead of merely reacting to performance scores, MEP compels the LLM to engage in a structured Reason-Act-Reflect cycle, forcing it to explicitly diagnose failures, formulate design hypotheses, and implement solutions grounded in pre-supplied domain knowledge. By applying MEP to evolve core components of the state-of-the-art Hybrid Genetic Search (HGS) algorithm, we discover novel heuristics that significantly outperform the original baseline. By steering the LLM to reason strategically about the exploration-exploitation trade-off, our approach discovers more effective and efficient heuristics applicable across a wide spectrum of VRP variants. Our results show that MEP discovers heuristics that yield significant performance gains over the original HGS baseline, improving solution quality by up to 2.70% and reducing runtime by over 45% on challenging VRP variants.

Vehicle Routing Problems (VRPs) are fundamental combinatorial optimization problems with widespread applications in various scenarios. The advanced optimization solvers can effectively solve such problems. However, modeling complex VRP variants for solvers often requires substantial domain expertise, which limits the accessibility of advanced optimization technologies. In this paper, we propose Reinforcement Learning Enhanced LLMAgents(RLEA), a multi-agent framework designed to automate the modeling of complex VRPs. RLEA introduces a lightweight neural Planner trained with Soft Q-learning to efficiently orchestrate the actions of LLM-based agents. In addition, we equip the system with an evolutionary memory module and retrieval-augmented generation, enabling the agent to leverage both accumulated experience and external solver knowledge during program generation and refinement for solving VRPs. We evaluated 48 distinct VRP variants across various solvers. The experimental results demonstrate that RLEA outperforms the previous state-of-the-ar method, achieving a 16.67% higher success rate while significantly reducing runtime errors. These results validate that integrating reinforcement learning with LLM-based reasoning is highly effective for automated optimization modeling. The appendix is available at: https://doi.org/10.5281/zenodo.19134435.