Chuanbo Hua

Federico Berto, Chuanbo Hua, Junyoung Park et al. · pku

Combinatorial optimization (CO) is fundamental to several real-world applications, from logistics and scheduling to hardware design and resource allocation. Deep reinforcement learning (RL) has recently shown significant benefits in solving CO problems, reducing reliance on domain expertise and improving computational efficiency. However, the absence of a unified benchmarking framework leads to inconsistent evaluations, limits reproducibility, and increases engineering overhead, raising barriers to adoption for new researchers. To address these challenges, we introduce RL4CO, a unified and extensive benchmark with in-depth library coverage of 27 CO problem environments and 23 state-of-the-art baselines. Built on efficient software libraries and best practices in implementation, RL4CO features modularized implementation and flexible configurations of diverse environments, policy architectures, RL algorithms, and utilities with extensive documentation. RL4CO helps researchers build on existing successes while exploring and developing their own designs, facilitating the entire research process by decoupling science from heavy engineering. We finally provide extensive benchmark studies to inspire new insights and future work. RL4CO has already attracted numerous researchers in the community and is open-sourced at https://github.com/ai4co/rl4co.

Federico Berto, Chuanbo Hua, Laurin Luttmann et al.

Combinatorial optimization problems involving multiple agents are notoriously challenging due to their NP-hard nature and the necessity for effective agent coordination. Despite advancements in learning-based methods, existing approaches often face critical limitations, including suboptimal agent coordination, poor generalization, and high computational latency. To address these issues, we propose PARCO (Parallel AutoRegressive Combinatorial Optimization), a general reinforcement learning framework designed to construct high-quality solutions for multi-agent combinatorial tasks efficiently. To this end, PARCO integrates three key novel components: (1) transformer-based communication layers to enable effective agent collaboration during parallel solution construction, (2) a multiple pointer mechanism for low-latency, parallel agent decision-making, and (3) priority-based conflict handlers to resolve decision conflicts via learned priorities. We evaluate PARCO in multi-agent vehicle routing and scheduling problems, where our approach outperforms state-of-the-art learning methods, demonstrating strong generalization ability and remarkable computational efficiency. We make our source code publicly available to foster future research: https://github.com/ai4co/parco.

Zihan Ma, Zhikai Zhao, Chuanbo Hua et al.

Optimizing LLM-based agentic workflows is challenging for scaling AI capabilities. Current methods rely on coarse, end-to-end evaluation signals and lack fine-grained signals on where to refine, often resulting in inefficient or low-impact modifications. To address these limitations, we propose {\our{}}, an Evaluation-Judge-Optimization-Update pipeline. We incorporate reusable, configurable logic blocks into agentic workflows to capture fundamental forms of logic. On top of this abstraction, we design a dedicated Judge module that inspects execution traces -- particularly failed runs -- and assigns rank-based responsibility scores to problematic blocks. These fine-grained diagnostic signals are then leveraged by an LLM-based optimizer, which focuses modifications on the most problematic block in the workflow. Our approach improves sample efficiency, enhances interpretability through block-level diagnostics, and provides a scalable foundation for automating increasingly complex agentic workflows. We evaluate {\our{}} on mathematical reasoning and code generation benchmarks, where {\our{}} achieves superior performance and efficiency compared to existing methods. The source code is publicly available at https://github.com/ma-zihan/JudgeFlow.

Jiachen Li, Chuanbo Hua, Jinkyoo Park et al.

While the modeling of pair-wise relations has been widely studied in multi-agent interacting systems, its ability to capture higher-level and larger-scale group-wise activities is limited. In this paper, we propose a group-aware relational reasoning approach (named EvolveHypergraph) with explicit inference of the underlying dynamically evolving relational structures, and we demonstrate its effectiveness for multi-agent trajectory prediction. In addition to the edges between a pair of nodes (i.e., agents), we propose to infer hyperedges that adaptively connect multiple nodes to enable group-aware relational reasoning in an unsupervised manner without fixing the number of hyperedges. The proposed approach infers the dynamically evolving relation graphs and hypergraphs over time to capture the evolution of relations, which are used by the trajectory predictor to obtain future states. Moreover, we propose to regularize the smoothness of the relation evolution and the sparsity of the inferred graphs or hypergraphs, which effectively improves training stability and enhances the explainability of inferred relations. The proposed approach is validated on both synthetic crowd simulations and multiple real-world benchmark datasets. Our approach infers explainable, reasonable group-aware relations and achieves state-of-the-art performance in long-term prediction.

Chuanbo Hua, Federico Berto, Michael Poli et al.

While complex simulations of physical systems have been widely used in engineering and scientific computing, lowering their often prohibitive computational requirements has only recently been tackled by deep learning approaches. In this paper, we present GraphSplineNets, a novel deep-learning method to speed up the forecasting of physical systems by reducing the grid size and number of iteration steps of deep surrogate models. Our method uses two differentiable orthogonal spline collocation methods to efficiently predict response at any location in time and space. Additionally, we introduce an adaptive collocation strategy in space to prioritize sampling from the most important regions. GraphSplineNets improve the accuracy-speedup tradeoff in forecasting various dynamical systems with increasing complexity, including the heat equation, damped wave propagation, Navier-Stokes equations, and real-world ocean currents in both regular and irregular domains.

Zhikai Zhao, Chuanbo Hua, Federico Berto et al.

Trajectory prediction is a crucial task in modeling human behavior, especially in fields as social robotics and autonomous vehicle navigation. Traditional heuristics based on handcrafted rules often lack accuracy, while recently proposed deep learning approaches suffer from computational cost, lack of explainability, and generalization issues that limit their practical adoption. In this paper, we introduce TrajEvo, a framework that leverages Large Language Models (LLMs) to automatically design trajectory prediction heuristics. TrajEvo employs an evolutionary algorithm to generate and refine prediction heuristics from past trajectory data. We introduce a Cross-Generation Elite Sampling to promote population diversity and a Statistics Feedback Loop allowing the LLM to analyze alternative predictions. Our evaluations show TrajEvo outperforms previous heuristic methods on the ETH-UCY datasets, and remarkably outperforms both heuristics and deep learning methods when generalizing to the unseen SDD dataset. TrajEvo represents a first step toward automated design of fast, explainable, and generalizable trajectory prediction heuristics. We make our source code publicly available to foster future research at https://github.com/ai4co/trajevo.

Chuanbo Hua, Federico Berto, Jiwoo Son et al.

The profiled vehicle routing problem (PVRP) is a generalization of the heterogeneous capacitated vehicle routing problem (HCVRP) in which the objective is to optimize the routes of vehicles to serve client demands subject to different vehicle profiles, with each having a preference or constraint on a per-client basis. While existing learning methods have shown promise for solving the HCVRP in real-time, no learning method exists to solve the more practical and challenging PVRP. In this paper, we propose a Collaborative Attention Model with Profiles (CAMP), a novel approach that learns efficient solvers for PVRP using multi-agent reinforcement learning. CAMP employs a specialized attention-based encoder architecture to embed profiled client embeddings in parallel for each vehicle profile. We design a communication layer between agents for collaborative decision-making across profiled embeddings at each decoding step and a batched pointer mechanism to attend to the profiled embeddings to evaluate the likelihood of the next actions. We evaluate CAMP on two variants of PVRPs: PVRP with preferences, which explicitly influence the reward function, and PVRP with zone constraints with different numbers of agents and clients, demonstrating that our learned solvers achieve competitive results compared to both classical state-of-the-art neural multi-agent models in terms of solution quality and computational efficiency. We make our code openly available at https://github.com/ai4co/camp.

Jiwoo Son, Zhikai Zhao, Federico Berto et al.

Vehicle Routing Problems (VRPs) are a class of NP-hard problems ubiquitous in several real-world logistics scenarios that pose significant challenges for optimization. Neural Combinatorial Optimization (NCO) has emerged as a promising alternative to classical approaches, as it can learn fast heuristics to solve VRPs. However, most research works in NCO for VRPs focus on simplified settings, which do not account for asymmetric distances and travel durations that cannot be derived by simple Euclidean distances and unrealistic data distributions, hindering real-world deployment. This work introduces RRNCO (Real Routing NCO) to bridge the gap of NCO between synthetic and real-world VRPs in the critical aspects of both data and modeling. First, we introduce a new, openly available dataset with real-world data containing a diverse dataset of locations, distances, and duration matrices from 100 cities, considering realistic settings with actual routing distances and durations obtained from Open Source Routing Machine (OSRM). Second, we propose a novel approach that efficiently processes both node and edge features through contextual gating, enabling the construction of more informed node embedding, and we finally incorporate an Adaptation Attention Free Module (AAFM) with neural adaptive bias mechanisms that effectively integrates not only distance matrices but also angular relationships between nodes, allowing our model to capture rich structural information. RRNCO achieves state-of-the-art results in real-world VRPs among NCO methods. We make our dataset and code publicly available at https://github.com/ai4co/real-routing-nco.

Yi Chen, Wonjin Shin, Shuhong Liu et al.

Large foundation models (LFMs) achieve strong performance through scaling, yet current structural pruning methods derive fixed pruning decisions during inference, overlooking sparsity patterns that emerge in the autoregressive token generation. In this paper, we propose POP (Partition-guided Online Pruning), an efficient online structural pruning framework that enables context-conditioned dynamic pruning with minimal computational overhead. POP partitions model channels into retained, candidate, and pruned regions, where prefilling defines a coarse pruning partition, and the decoding stage generates a fine-grained mask within the candidate region, avoiding full-channel re-evaluation. The coarse pruning partition preserves consistently important weights, while the fine-grained masking provides context-conditioned variation during decoding. Moreover, POP is a lightweight, plug-and-play method that requires no preprocessing, including offline calibration, retraining, or learning predictors. Extensive evaluations across diverse LFMs, including large language models (LLMs), mixture-of-experts models (MoEs), and vision-language models (VLMs), demonstrate that POP consistently delivers higher accuracy than existing pruning approaches while incurring smaller computational overhead and minimizing inference latency.

Zhikai Zhao, Chuanbo Hua, Federico Berto et al.

Trajectory prediction is a critical task in modeling human behavior, especially in safety-critical domains such as social robotics and autonomous vehicle navigation. Traditional heuristics based on handcrafted rules often lack accuracy and generalizability. Although deep learning approaches offer improved performance, they typically suffer from high computational cost, limited explainability, and, importantly, poor generalization to out-of-distribution (OOD) scenarios. In this paper, we introduce TrajEvo, a framework that leverages Large Language Models (LLMs) to automatically design trajectory prediction heuristics. TrajEvo employs an evolutionary algorithm to generate and refine prediction heuristics from past trajectory data. We propose two key innovations: Cross-Generation Elite Sampling to encourage population diversity, and a Statistics Feedback Loop that enables the LLM to analyze and improve alternative predictions. Our evaluations demonstrate that TrajEvo outperforms existing heuristic methods across multiple real-world datasets, and notably surpasses both heuristic and deep learning methods in generalizing to an unseen OOD real-world dataset. TrajEvo marks a promising step toward the automated design of fast, explainable, and generalizable trajectory prediction heuristics. We release our source code to facilitate future research at https://github.com/ai4co/trajevo.

Zhikai Zhao, Chuanbo Hua, Federico Berto et al.

Robot navigation is a crucial task with applications to social robots in dynamic human environments. While Reinforcement Learning (RL) has shown great promise for this problem, the policy quality is highly sensitive to the specification of reward functions. Hand-crafted rewards require substantial domain expertise and embed inductive biases that are difficult to audit or adapt, limiting their effectiveness and leading to suboptimal performance. In this paper, we propose EvoNav, an evolutionary framework that automates the design of robot navigation reward functions via large language models (LLMs). To overcome prohibitively costly policy training, EvoNav evaluates each candidate proposal from the LLM via a progressive three-stage warm-up-boost procedure. EvoNav advances from analytical proxies with low-cost surrogates, such as small datasets and analytic rules, to lightweight rollouts and, finally, to full policy training, enabling computationally efficient exploration under effective feedback. Experiment results show that EvoNav produces more effective navigation policies than manually designed RL rewards and state-of-the-art reward design methods.

Chuanbo Hua, Federico Berto, Andre Hottung et al.

Transformer-based models have become the dominant paradigm for neural combinatorial optimization (NCO) of vehicle routing problems (VRPs), yet the role of positional encoding (PE) in these architectures remains largely unexplored. Unlike natural language, where tokens are uniformly spaced on a line, routing solutions exhibit several properties that render standard NLP positional encodings inadequate. In this work, we formalize three such structural properties that a routing-aware PE should respect, namely anisometric node distances, cyclic and direction-aware topology, and hierarchical depot-anchored global multi-route structure, combining them with a unifying design principle of geometric grounding. Guided by these criteria, we analyze and compare PE methods spanning NLP, graph-transformer, and routing-specific families, and propose a hierarchical anisometric PE that combines a distance-indexed, circularly consistent in-route encoding with a depot-anchored angular cross-route encoding. Extensive experiments across diverse VRP variants demonstrate that geometry-grounded PE consistently outperforms index-based alternatives, with gains that transfer across problem variants, model architectures, and distribution shifts.

Haoran Ye, Jiarui Wang, Zhiguang Cao et al. · pku

The omnipresence of NP-hard combinatorial optimization problems (COPs) compels domain experts to engage in trial-and-error heuristic design. The long-standing endeavor of design automation has gained new momentum with the rise of large language models (LLMs). This paper introduces Language Hyper-Heuristics (LHHs), an emerging variant of Hyper-Heuristics that leverages LLMs for heuristic generation, featuring minimal manual intervention and open-ended heuristic spaces. To empower LHHs, we present Reflective Evolution (ReEvo), a novel integration of evolutionary search for efficiently exploring the heuristic space, and LLM reflections to provide verbal gradients within the space. Across five heterogeneous algorithmic types, six different COPs, and both white-box and black-box views of COPs, ReEvo yields state-of-the-art and competitive meta-heuristics, evolutionary algorithms, heuristics, and neural solvers, while being more sample-efficient than prior LHHs.

Federico Berto, Chuanbo Hua, Nayeli Gast Zepeda et al.

This paper introduces RouteFinder, a comprehensive foundation model framework to tackle different Vehicle Routing Problem (VRP) variants. Our core idea is that a foundation model for VRPs should be able to represent variants by treating each as a subset of a generalized problem equipped with different attributes. We propose a unified VRP environment capable of efficiently handling any combination of these attributes. The RouteFinder model leverages a modern transformer-based encoder and global attribute embeddings to improve task representation. Additionally, we introduce two reinforcement learning techniques to enhance multi-task performance: mixed batch training, which enables training on different variants at once, and multi-variant reward normalization to balance different reward scales. Finally, we propose efficient adapter layers that enable fine-tuning for new variants with unseen attributes. Extensive experiments on 48 VRP variants show RouteFinder outperforms recent state-of-the-art learning methods. Our code is publicly available at https://github.com/ai4co/routefinder.

Jiachen Li, Chuanbo Hua, Jianpeng Yao et al.

Social robot navigation can be helpful in various contexts of daily life but requires safe human-robot interactions and efficient trajectory planning. While modeling pairwise relations has been widely studied in multi-agent interacting systems, the ability to capture larger-scale group-wise activities is limited. In this paper, we propose a systematic relational reasoning approach with explicit inference of the underlying dynamically evolving relational structures, and we demonstrate its effectiveness for multi-agent trajectory prediction and social robot navigation. In addition to the edges between pairs of nodes (i.e., agents), we propose to infer hyperedges that adaptively connect multiple nodes to enable group-wise reasoning in an unsupervised manner. Our approach infers dynamically evolving relation graphs and hypergraphs to capture the evolution of relations, which the trajectory predictor employs to generate future states. Meanwhile, we propose to regularize the sharpness and sparsity of the learned relations and the smoothness of the relation evolution, which proves to enhance training stability and model performance. The proposed approach is validated on synthetic crowd simulations and real-world benchmark datasets. Experiments demonstrate that the approach infers reasonable relations and achieves state-of-the-art prediction performance. In addition, we present a deep reinforcement learning (DRL) framework for social robot navigation, which incorporates relational reasoning and trajectory prediction systematically. In a group-based crowd simulation, our method outperforms the strongest baseline by a significant margin in terms of safety, efficiency, and social compliance in dense, interactive scenarios. We also demonstrate the practical applicability of our method with real-world robot experiments. The code and videos can be found at https://relational-reasoning-nav.github.io/.

Huijie Tang, Federico Berto, Zihan Ma et al.

Large-scale multi-agent pathfinding (MAPF) presents significant challenges in several areas. As systems grow in complexity with a multitude of autonomous agents operating simultaneously, efficient and collision-free coordination becomes paramount. Traditional algorithms often fall short in scalability, especially in intricate scenarios. Reinforcement Learning (RL) has shown potential to address the intricacies of MAPF; however, it has also been shown to struggle with scalability, demanding intricate implementation, lengthy training, and often exhibiting unstable convergence, limiting its practical application. In this paper, we introduce Heuristics-Informed Multi-Agent Pathfinding (HiMAP), a novel scalable approach that employs imitation learning with heuristic guidance in a decentralized manner. We train on small-scale instances using a heuristic policy as a teacher that maps each single agent observation information to an action probability distribution. During pathfinding, we adopt several inference techniques to improve performance. With a simple training scheme and implementation, HiMAP demonstrates competitive results in terms of success rate and scalability in the field of imitation-learning-only MAPF, showing the potential of imitation-learning-only MAPF equipped with inference techniques.

Subin Lin, Chuanbo Hua

Accurate building energy forecasting is essential, yet traditional heuristics often lack precision, while advanced models can be opaque and struggle with generalization by neglecting physical principles. This paper introduces BuildEvo, a novel framework that uses Large Language Models (LLMs) to automatically design effective and interpretable energy prediction heuristics. Within an evolutionary process, BuildEvo guides LLMs to construct and enhance heuristics by systematically incorporating physical insights from building characteristics and operational data (e.g., from the Building Data Genome Project 2). Evaluations show BuildEvo achieves state-of-the-art performance on benchmarks, offering improved generalization and transparent prediction logic. This work advances the automated design of robust, physically grounded heuristics, promoting trustworthy models for complex energy systems.

Yi Chen, Mu-Young Son, Chuanbo Hua et al.

The Segment Anything Model (SAM) is a powerful foundation model for image segmentation, showing robust zero-shot generalization through prompt engineering. However, relying on manual prompts is impractical for real-world applications, particularly in scenarios where rapid prompt provision and resource efficiency are crucial. In this paper, we propose the Automation of Prompts for SAM (AoP-SAM), a novel approach that learns to generate essential prompts in optimal locations automatically. AoP-SAM enhances SAM's efficiency and usability by eliminating manual input, making it better suited for real-world tasks. Our approach employs a lightweight yet efficient Prompt Predictor model that detects key entities across images and identifies the optimal regions for placing prompt candidates. This method leverages SAM's image embeddings, preserving its zero-shot generalization capabilities without requiring fine-tuning. Additionally, we introduce a test-time instance-level Adaptive Sampling and Filtering mechanism that generates prompts in a coarse-to-fine manner. This notably enhances both prompt and mask generation efficiency by reducing computational overhead and minimizing redundant mask refinements. Evaluations of three datasets demonstrate that AoP-SAM substantially improves both prompt generation efficiency and mask generation accuracy, making SAM more effective for automated segmentation tasks.

André Hottung, Federico Berto, Chuanbo Hua et al. · pku

Designing high-performing heuristics for vehicle routing problems (VRPs) is a complex task that requires both intuition and deep domain knowledge. Large language model (LLM)-based code generation has recently shown promise across many domains, but it still falls short of producing heuristics that rival those crafted by human experts. In this paper, we propose VRPAgent, a framework that integrates LLM-generated components into a metaheuristic and refines them through a novel genetic search. By using the LLM to generate problem-specific operators, embedded within a generic metaheuristic framework, VRPAgent keeps tasks manageable, guarantees correctness, and still enables the discovery of novel and powerful strategies. Across multiple problems, including the capacitated VRP, the VRP with time windows, and the prize-collecting VRP, our method discovers heuristic operators that outperform handcrafted methods and recent learning-based approaches while requiring only a single CPU core. To our knowledge, \VRPAgent is the first LLM-based paradigm to advance the state-of-the-art in VRPs, highlighting a promising future for automated heuristics discovery.

Chuanbo Hua, Federico Berto, Zhikai Zhao et al.

The Profiled Vehicle Routing Problem (PVRP) extends the classical VRP by incorporating vehicle-client-specific preferences and constraints, reflecting real-world requirements such as zone restrictions and service-level preferences. While recent reinforcement-learning solvers have shown promising performance, they require retraining for each new profile distribution, suffer from poor representation ability, and struggle to generalize to out-of-distribution instances. In this paper, we address these limitations by introducing Unified Solver for Profiled Routing (USPR), a novel framework that natively handles arbitrary profile types. USPR introduces on three key innovations: (i) Profile Embeddings (PE) to encode any combination of profile types; (ii) Multi-Head Profiled Attention (MHPA), an attention mechanism that models rich interactions between vehicles and clients; (iii) Profile-aware Score Reshaping (PSR), which dynamically adjusts decoder logits using profile scores to improve generalization. Empirical results on diverse PVRP benchmarks demonstrate that USPR achieves state-of-the-art results among learning-based methods while offering significant gains in flexibility and computational efficiency. We make our source code publicly available to foster future research.

Subin Lin, Chuanbo Hua

Heating, Ventilation, and Air-Conditioning (HVAC) systems account for a substantial share of global building energy use, making reliable anomaly detection essential for improving efficiency and reducing emissions. Classical rule-based approaches offer explainability but lack adaptability, while deep learning methods provide predictive power at the cost of transparency, efficiency, and physical plausibility. Recent attempts to use Large Language Models (LLMs) for anomaly detection improve interpretability but largely ignore the physical principles that govern HVAC operations. We present PILLM, a Physics-Informed LLM framework that operates within an evolutionary loop to automatically generate, evaluate, and refine anomaly detection rules. Our approach introduces physics-informed reflection and crossover operators that embed thermodynamic and control-theoretic constraints, enabling rules that are both adaptive and physically grounded. Experiments on the public Building Fault Detection dataset show that PILLM achieves state-of-the-art performance while producing diagnostic rules that are interpretable and actionable, advancing trustworthy and deployable AI for smart building systems.