Yining Ma

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.

Dat Thanh Tran, Van Khu Vu, Yining Ma

Neural-guided Ant Colony Optimization (ACO) suffers from a fundamental training-inference misalignment: policies are typically trained to generate static priors (e.g., heatmaps), yet deployed to guide iterative, long-horizon search processes. In this paper, we present DyNACO, a novel framework that achieves dynamic neural guidance by periodically observing the pheromone distribution and the incumbent solution. To make DyNACO tractable at scale, we pair the policy with a perturbation-based ACO backend and a scope-restricted refinement mechanism that jointly ensure efficacy and stable credit assignment. On TSP, DyNACO scales to 100,000-node instances and outperforms neural baselines while often reducing total runtime compared to the unguided solver. We extend DyNACO to CVRP via a capacity-aware backend, consistently improving the unguided baseline with less than 1% neural overhead. We further provide in-depth analysis validating the model's generalization capabilities and elucidating why dynamic guidance outperforms static priors. Our work underscores the necessity of aligning neural training with iterative search dynamics in learning-guided optimization. The code is available at https://github.com/shoraaa/DyNACO.

Yining Ma, Zhiguang Cao, Yeow Meng Chee

In this paper, we present Neural k-Opt (NeuOpt), a novel learning-to-search (L2S) solver for routing problems. It learns to perform flexible k-opt exchanges based on a tailored action factorization method and a customized recurrent dual-stream decoder. As a pioneering work to circumvent the pure feasibility masking scheme and enable the autonomous exploration of both feasible and infeasible regions, we then propose the Guided Infeasible Region Exploration (GIRE) scheme, which supplements the NeuOpt policy network with feasibility-related features and leverages reward shaping to steer reinforcement learning more effectively. Additionally, we equip NeuOpt with Dynamic Data Augmentation (D2A) for more diverse searches during inference. Extensive experiments on the Traveling Salesman Problem (TSP) and Capacitated Vehicle Routing Problem (CVRP) demonstrate that our NeuOpt not only significantly outstrips existing (masking-based) L2S solvers, but also showcases superiority over the learning-to-construct (L2C) and learning-to-predict (L2P) solvers. Notably, we offer fresh perspectives on how neural solvers can handle VRP constraints. Our code is available: https://github.com/yining043/NeuOpt.

Zeyuan Ma, Hongshu Guo, Jiacheng Chen et al.

Recently, Meta-Black-Box Optimization with Reinforcement Learning (MetaBBO-RL) has showcased the power of leveraging RL at the meta-level to mitigate manual fine-tuning of low-level black-box optimizers. However, this field is hindered by the lack of a unified benchmark. To fill this gap, we introduce MetaBox, the first benchmark platform expressly tailored for developing and evaluating MetaBBO-RL methods. MetaBox offers a flexible algorithmic template that allows users to effortlessly implement their unique designs within the platform. Moreover, it provides a broad spectrum of over 300 problem instances, collected from synthetic to realistic scenarios, and an extensive library of 19 baseline methods, including both traditional black-box optimizers and recent MetaBBO-RL methods. Besides, MetaBox introduces three standardized performance metrics, enabling a more thorough assessment of the methods. In a bid to illustrate the utility of MetaBox for facilitating rigorous evaluation and in-depth analysis, we carry out a wide-ranging benchmarking study on existing MetaBBO-RL methods. Our MetaBox is open-source and accessible at: https://github.com/GMC-DRL/MetaBox.

Flint Xiaofeng Fan, Yining Ma, Zhongxiang Dai et al. · eth-zurich

Federated Reinforcement Learning (FedRL) encourages distributed agents to learn collectively from each other's experience to improve their performance without exchanging their raw trajectories. The existing work on FedRL assumes that all participating agents are homogeneous, which requires all agents to share the same policy parameterization (e.g., network architectures and training configurations). However, in real-world applications, agents are often in disagreement about the architecture and the parameters, possibly also because of disparate computational budgets. Because homogeneity is not given in practice, we introduce the problem setting of Federated Reinforcement Learning with Heterogeneous And bLack-box agEnts (FedRL-HALE). We present the unique challenges this new setting poses and propose the Federated Heterogeneous Q-Learning (FedHQL) algorithm that principally addresses these challenges. We empirically demonstrate the efficacy of FedHQL in boosting the sample efficiency of heterogeneous agents with distinct policy parameterization using standard RL tasks.

Jieyi Bi, Yining Ma, Jiahai Wang et al.

Recent neural methods for vehicle routing problems always train and test the deep models on the same instance distribution (i.e., uniform). To tackle the consequent cross-distribution generalization concerns, we bring the knowledge distillation to this field and propose an Adaptive Multi-Distribution Knowledge Distillation (AMDKD) scheme for learning more generalizable deep models. Particularly, our AMDKD leverages various knowledge from multiple teachers trained on exemplar distributions to yield a light-weight yet generalist student model. Meanwhile, we equip AMDKD with an adaptive strategy that allows the student to concentrate on difficult distributions, so as to absorb hard-to-master knowledge more effectively. Extensive experimental results show that, compared with the baseline neural methods, our AMDKD is able to achieve competitive results on both unseen in-distribution and out-of-distribution instances, which are either randomly synthesized or adopted from benchmark datasets (i.e., TSPLIB and CVRPLIB). Notably, our AMDKD is generic, and consumes less computational resources for inference.

Yining Ma, Jingwen Li, Zhiguang Cao et al.

We present an efficient Neural Neighborhood Search (N2S) approach for pickup and delivery problems (PDPs). In specific, we design a powerful Synthesis Attention that allows the vanilla self-attention to synthesize various types of features regarding a route solution. We also exploit two customized decoders that automatically learn to perform removal and reinsertion of a pickup-delivery node pair to tackle the precedence constraint. Additionally, a diversity enhancement scheme is leveraged to further ameliorate the performance. Our N2S is generic, and extensive experiments on two canonical PDP variants show that it can produce state-of-the-art results among existing neural methods. Moreover, it even outstrips the well-known LKH3 solver on the more constrained PDP variant. Our implementation for N2S is available online.

Yining Ma, Wei Jiang, Lingtong Zhang et al.

Interaction between the background vehicles (BVs) and automated vehicles (AVs) in scenario-based testing plays a critical role in evaluating the intelligence of the AVs. Current testing scenarios typically employ predefined or scripted BVs, which inadequately reflect the complexity of human-like social behaviors in real-world driving scenarios, and also lack a systematic metric for evaluating the comprehensive intelligence of AVs. Therefore, this paper proposes an evolving scenario generation method that utilizes deep reinforcement learning (DRL) to create human-like BVs for testing and intelligence evaluation of AVs. Firstly, a class of driver models with human-like competitive, cooperative, and mutual driving motivations is designed. Then, utilizing an improved "level-k" training procedure, the three distinct driver models acquire game-based interactive driving policies. And these models are assigned to BVs for generating evolving scenarios in which all BVs can interact continuously and evolve diverse contents. Next, a framework including safety, driving efficiency, and interaction utility are presented to evaluate and quantify the intelligence performance of 3 systems under test (SUTs), indicating the effectiveness of the evolving scenario for intelligence testing. Finally, the complexity and fidelity of the proposed evolving testing scenario are validated. The results demonstrate that the proposed evolving scenario exhibits the highest level of complexity compared to other baseline scenarios and has more than 85% similarity to naturalistic driving data. This highlights the potential of the proposed method to facilitate the development and evaluation of high-level AVs in a realistic and challenging environment.

Jinbiao Chen, Zizhen Zhang, Zhiguang Cao et al.

Most of existing neural methods for multi-objective combinatorial optimization (MOCO) problems solely rely on decomposition, which often leads to repetitive solutions for the respective subproblems, thus a limited Pareto set. Beyond decomposition, we propose a novel neural heuristic with diversity enhancement (NHDE) to produce more Pareto solutions from two perspectives. On the one hand, to hinder duplicated solutions for different subproblems, we propose an indicator-enhanced deep reinforcement learning method to guide the model, and design a heterogeneous graph attention mechanism to capture the relations between the instance graph and the Pareto front graph. On the other hand, to excavate more solutions in the neighborhood of each subproblem, we present a multiple Pareto optima strategy to sample and preserve desirable solutions. Experimental results on classic MOCO problems show that our NHDE is able to generate a Pareto front with higher diversity, thereby achieving superior overall performance. Moreover, our NHDE is generic and can be applied to different neural methods for MOCO.

Yong Liang Goh, Zhiguang Cao, Yining Ma et al.

Existing neural constructive solvers for routing problems have predominantly employed transformer architectures, conceptualizing the route construction as a set-to-sequence learning task. However, their efficacy has primarily been demonstrated on entirely random problem instances that inadequately capture real-world scenarios. In this paper, we introduce realistic Traveling Salesman Problem (TSP) scenarios relevant to industrial settings and derive the following insights: (1) The optimal next node (or city) to visit often lies within proximity to the current node, suggesting the potential benefits of biasing choices based on current locations. (2) Effectively solving the TSP requires robust tracking of unvisited nodes and warrants succinct grouping strategies. Building upon these insights, we propose integrating a learnable choice layer inspired by Hypernetworks to prioritize choices based on the current location, and a learnable approximate clustering algorithm inspired by the Expectation-Maximization algorithm to facilitate grouping the unvisited cities. Together, these two contributions form a hierarchical approach towards solving the realistic TSP by considering both immediate local neighbourhoods and learning an intermediate set of node representations. Our hierarchical approach yields superior performance compared to both classical and recent transformer models, showcasing the efficacy of the key designs.

Jianan Zhou, Zhiguang Cao, Yaoxin Wu et al.

Learning to solve vehicle routing problems (VRPs) has garnered much attention. However, most neural solvers are only structured and trained independently on a specific problem, making them less generic and practical. In this paper, we aim to develop a unified neural solver that can cope with a range of VRP variants simultaneously. Specifically, we propose a multi-task vehicle routing solver with mixture-of-experts (MVMoE), which greatly enhances the model capacity without a proportional increase in computation. We further develop a hierarchical gating mechanism for the MVMoE, delivering a good trade-off between empirical performance and computational complexity. Experimentally, our method significantly promotes zero-shot generalization performance on 10 unseen VRP variants, and showcases decent results on the few-shot setting and real-world benchmark instances. We further conduct extensive studies on the effect of MoE configurations in solving VRPs, and observe the superiority of hierarchical gating when facing out-of-distribution data. The source code is available at: https://github.com/RoyalSkye/Routing-MVMoE.

Han Zheng, Yining Ma, Brandon Araki et al.

Lifelong Multi-Agent Path Finding (MAPF) is critical for modern warehouse automation, which requires multiple robots to continuously navigate conflict-free paths to optimize the overall system throughput. However, the complexity of warehouse environments and the long-term dynamics of lifelong MAPF often demand costly adaptations to classical search-based solvers. While machine learning methods have been explored, their superiority over search-based methods remains inconclusive. In this paper, we introduce Reinforcement Learning (RL) guided Rolling Horizon Prioritized Planning (RL-RH-PP), the first framework integrating RL with search-based planning for lifelong MAPF. Specifically, we leverage classical Prioritized Planning (PP) as a backbone for its simplicity and flexibility in integrating with a learning-based priority assignment policy. By formulating dynamic priority assignment as a Partially Observable Markov Decision Process (POMDP), RL-RH-PP exploits the sequential decision-making nature of lifelong planning while delegating complex spatial-temporal interactions among agents to reinforcement learning. An attention-based neural network autoregressively decodes priority orders on-the-fly, enabling efficient sequential single-agent planning by the PP planner. Evaluations in realistic warehouse simulations show that RL-RH-PP achieves the highest total throughput among baselines and generalizes effectively across agent densities, planning horizons, and warehouse layouts. Our interpretive analyses reveal that RL-RH-PP proactively prioritizes congested agents and strategically redirects agents from congestion, easing traffic flow and boosting throughput. These findings highlight the potential of learning-guided approaches to augment traditional heuristics in modern warehouse automation.

Peixin Huang, Yaoxin Wu, Yining Ma et al.

Mixed-integer linear programming (MILP), a widely used modeling framework for combinatorial optimization, are central to many scientific and engineering applications, yet remains computationally challenging at scale. Recent advances in deep learning address this challenge by representing MILP instances as variable-constraint bipartite graphs and applying graph neural networks (GNNs) to extract latent structural patterns and enhance solver efficiency. However, this architecture is inherently limited by the local-oriented mechanism, leading to restricted representation power and hindering neural approaches for MILP. Here we present an attention-driven neural architecture that learns expressive representations beyond the pure graph view. A dual-attention mechanism is designed to perform parallel self- and cross-attention over variables and constraints, enabling global information exchange and deeper representation learning. We apply this general backbone to various downstream tasks at the instance level, element level, and solving state level. Extensive experiments across widely used benchmarks show consistent improvements of our approach over state-of-the-art baselines, highlighting attention-based neural architectures as a powerful foundation for learning-enhanced mixed-integer linear optimization.

Jieyi Bi, Zhiguang Cao, Jianan Zhou et al.

Neural solvers have achieved impressive progress in addressing simple routing problems, particularly excelling in computational efficiency. However, their advantages under complex constraints remain nascent, for which current constraint-handling schemes via feasibility masking or implicit feasibility awareness can be inefficient or inapplicable for hard constraints. In this paper, we present Construct-and-Refine (CaR), the first general and efficient constraint-handling framework for neural routing solvers based on explicit learning-based feasibility refinement. Unlike prior construction-search hybrids that target reducing optimality gaps through heavy improvements yet still struggle with hard constraints, CaR achieves efficient constraint handling by designing a joint training framework that guides the construction module to generate diverse and high-quality solutions well-suited for a lightweight improvement process, e.g., 10 steps versus 5k steps in prior work. Moreover, CaR presents the first use of construction-improvement-shared representation, enabling potential knowledge sharing across paradigms by unifying the encoder, especially in more complex constrained scenarios. We evaluate CaR on typical hard routing constraints to showcase its broader applicability. Results demonstrate that CaR achieves superior feasibility, solution quality, and efficiency compared to both classical and neural state-of-the-art solvers.

Hang Yi, Ziwei Huang, Yining Ma et al.

Recent neural solvers have achieved strong performance on vehicle routing problems (VRPs), yet they mainly assume symmetric Euclidean distances, restricting applicability to real-world scenarios. A core challenge is encoding the relational features in asymmetric distance matrices of VRPs. Early attempts directly encoded these matrices but often failed to produce compact embeddings and generalized poorly at scale. In this paper, we propose RADAR, a scalable neural framework that augments existing neural VRP solvers with the ability to handle asymmetric inputs. RADAR addresses asymmetry from both static and dynamic perspectives. It leverages Singular Value Decomposition (SVD) on the asymmetric distance matrix to initialize compact and generalizable embeddings that inherently encode the static asymmetry in the inbound and outbound costs of each node. To further model dynamic asymmetry in embedding interactions during encoding, it replaces the standard softmax with Sinkhorn normalization that imposes joint row and column distance awareness in attention weights. Extensive experiments on synthetic and real-world benchmarks across various VRPs show that RADAR outperforms strong baselines on both in-distribution and out-of-distribution instances, demonstrating robust generalization and superior performance in solving asymmetric VRPs.

Jing Sun, Shuo Chen, Cong Zhang et al.

Opponent modelling has proven effective in enhancing the decision-making of the controlled agent by constructing models of opponent agents. However, existing methods often rely on access to the observations and actions of opponents, a requirement that is infeasible when such information is either unobservable or challenging to obtain. To address this issue, we introduce Distributional Opponent-aided Multi-agent Actor-Critic (DOMAC), the first speculative opponent modelling algorithm that relies solely on local information (i.e., the controlled agent's observations, actions, and rewards). Specifically, the actor maintains a speculated belief about the opponents using the tailored speculative opponent models that predict the opponents' actions using only local information. Moreover, DOMAC features distributional critic models that estimate the return distribution of the actor's policy, yielding a more fine-grained assessment of the actor's quality. This thus more effectively guides the training of the speculative opponent models that the actor depends upon. Furthermore, we formally derive a policy gradient theorem with the proposed opponent models. Extensive experiments under eight different challenging multi-agent benchmark tasks within the MPE, Pommerman and StarCraft Multiagent Challenge (SMAC) demonstrate that our DOMAC successfully models opponents' behaviours and delivers superior performance against state-of-the-art methods with a faster convergence speed.

Hongshu Guo, Zeyuan Ma, Yining Ma et al.

Designing effective black-box optimizers is hampered by limited problem-specific knowledge and manual control that spans months for almost every detail. In this paper, we present \textit{DesignX}, the first automated algorithm design framework that generates an effective optimizer specific to a given black-box optimization problem within seconds. Rooted in the first principles, we identify two key sub-tasks: 1) algorithm structure generation and 2) hyperparameter control. To enable systematic construction, a comprehensive modular algorithmic space is first built, embracing hundreds of algorithm components collected from decades of research. We then introduce a dual-agent reinforcement learning system that collaborates on structural and parametric design through a novel cooperative training objective, enabling large-scale meta-training across 10k diverse instances. Remarkably, through days of autonomous learning, the DesignX-generated optimizers continuously surpass human-crafted optimizers by orders of magnitude, either on synthetic testbed or on realistic optimization scenarios such as Protein-docking, AutoML and UAV path planning. Further in-depth analysis reveals DesignX's capability to discover non-trivial algorithm patterns beyond expert intuition, which, conversely, provides valuable design insights for the optimization community. We provide DesignX's Python project at~ https://github.com/MetaEvo/DesignX.

Zeyuan Ma, Yue-Jiao Gong, Hongshu Guo et al.

Meta-Black-Box Optimization (MetaBBO) streamlines the automation of optimization algorithm design through meta-learning. It typically employs a bi-level structure: the meta-level policy undergoes meta-training to reduce the manual effort required in developing algorithms for low-level optimization tasks. The original MetaBox (2023) provided the first open-source framework for reinforcement learning-based single-objective MetaBBO. However, its relatively narrow scope no longer keep pace with the swift advancement in this field. In this paper, we introduce MetaBox-v2 (https://github.com/MetaEvo/MetaBox) as a milestone upgrade with four novel features: 1) a unified architecture supporting RL, evolutionary, and gradient-based approaches, by which we reproduce $23$ up-to-date baselines; 2) efficient parallelization schemes, which reduce the training/testing time by $10-40$x; 3) a comprehensive benchmark suite of $18$ synthetic/realistic tasks ($1900$+ instances) spanning single-objective, multi-objective, multi-model, and multi-task optimization scenarios; 4) plentiful and extensible interfaces for custom analysis/visualization and integrating to external optimization tools/benchmarks. To show the utility of MetaBox-v2, we carry out a systematic case study that evaluates the built-in baselines in terms of the optimization performance, generalization ability and learning efficiency. Valuable insights are concluded from thorough and detailed analysis for practitioners and those new to the field.

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.

Han Zheng, Yining Ma, Karthick Gunasekaran et al.

In LLM Reinforcement Fine-Tuning (RFT), curriculum learning drives both efficiency and performance. Yet, current methods externalize curriculum judgment via handcrafted heuristics or auxiliary models, risking misalignment with the policy's training dynamics. In this paper, we introduce METIS (METacognitive Internalized Self-judgment), a novel framework that internalizes curriculum judgment as a native capability. Leveraging a critical observation that within-prompt reward variance effectively gauges prompt informativeness, METIS predicts this metric based on recent training outcomes as lightweight in-context learning examples. This intrinsic self-judgment then dynamically dictates the training allocation. Moreover, METIS closes the loop between judgment and optimization by jointly optimizing the standard RFT rewards and a self-judgment reward. This allows the policy to learn what to learn next, as a form of metacognition. Across extensive discrete and continuous RFT benchmarks from mathematical reasoning, code generation, to agentic function-calling, METIS consistently delivers superior performance while accelerating convergence by up to 67%. By bypassing handcrafted heuristics and auxiliary models, our work establishes a simple, closed-loop, and highly efficient curriculum internalization paradigm for LLM reinforcement fine-tuning.

Minwei Kong, Ao Qu, Xiaotong Guo et al.

Optimization modeling enables critical decisions across industries but remains difficult to automate: informal language must be mapped to precise mathematical formulations and executable solver code. Prior LLM approaches either rely on brittle prompting or costly retraining with limited generalization. We present AlphaOPT, a self-improving experience library that enables an LLM to learn from limited demonstrations (even answers alone, without gold-standard programs) and solver feedback - without annotated reasoning traces or parameter updates. AlphaOPT operates in a continual two-phase cycle: (i) a Library Learning phase that reflects on failed attempts, extracting solver-verified, structured insights as {taxonomy, condition, explanation, example}; and (ii) a Library Evolution phase that diagnoses retrieval misalignments and refines the applicability conditions of stored insights, improving transfer across tasks. This design (1) learns efficiently from limited demonstrations without curated rationales, (2) expands continually without costly retraining by updating the library rather than model weights, and (3) makes knowledge explicit and interpretable for human inspection and intervention. Experiments show that AlphaOPT steadily improves with more data (65% to 72% from 100 to 300 training items) and surpasses the strongest baseline by 7.7% on the out-of-distribution OptiBench dataset when trained only on answers. Code and data are available at: https://github.com/Minw913/AlphaOPT.

Zeyuan Ma, Hongshu Guo, Jiacheng Chen et al.

Recent research explores optimization using large language models (LLMs) by either iteratively seeking next-step solutions from LLMs or directly prompting LLMs for an optimizer. However, these approaches exhibit inherent limitations, including low operational efficiency, high sensitivity to prompt design, and a lack of domain-specific knowledge. We introduce LLaMoCo, the first instruction-tuning framework designed to adapt LLMs for solving optimization problems in a code-to-code manner. Specifically, we establish a comprehensive instruction set containing well-described problem prompts and effective optimization codes. We then develop a novel two-phase learning strategy that incorporates a contrastive learning-based warm-up procedure before the instruction-tuning phase to enhance the convergence behavior during model fine-tuning. The experiment results demonstrate that a CodeGen (350M) model fine-tuned by our LLaMoCo achieves superior optimization performance compared to GPT-4 Turbo and the other competitors across both synthetic and realistic problem sets. The fine-tuned model and the usage instructions are available at https://anonymous.4open.science/r/LLaMoCo-722A.

Hongshu Guo, Yining Ma, Zeyuan Ma et al.

Evolutionary algorithms, such as Differential Evolution, excel in solving real-parameter optimization challenges. However, the effectiveness of a single algorithm varies across different problem instances, necessitating considerable efforts in algorithm selection or configuration. This paper aims to address the limitation by leveraging the complementary strengths of a group of algorithms and dynamically scheduling them throughout the optimization progress for specific problems. We propose a deep reinforcement learning-based dynamic algorithm selection framework to accomplish this task. Our approach models the dynamic algorithm selection a Markov Decision Process, training an agent in a policy gradient manner to select the most suitable algorithm according to the features observed during the optimization process. To empower the agent with the necessary information, our framework incorporates a thoughtful design of landscape and algorithmic features. Meanwhile, we employ a sophisticated deep neural network model to infer the optimal action, ensuring informed algorithm selections. Additionally, an algorithm context restoration mechanism is embedded to facilitate smooth switching among different algorithms. These mechanisms together enable our framework to seamlessly select and switch algorithms in a dynamic online fashion. Notably, the proposed framework is simple and generic, offering potential improvements across a broad spectrum of evolutionary algorithms. As a proof-of-principle study, we apply this framework to a group of Differential Evolution algorithms. The experimental results showcase the remarkable effectiveness of the proposed framework, not only enhancing the overall optimization performance but also demonstrating favorable generalization ability across different problem classes.

Jieyi Bi, Yining Ma, Jianan Zhou et al.

Vehicle Routing Problems (VRPs) can model many real-world scenarios and often involve complex constraints. While recent neural methods excel in constructing solutions based on feasibility masking, they struggle with handling complex constraints, especially when obtaining the masking itself is NP-hard. In this paper, we propose a novel Proactive Infeasibility Prevention (PIP) framework to advance the capabilities of neural methods towards more complex VRPs. Our PIP integrates the Lagrangian multiplier as a basis to enhance constraint awareness and introduces preventative infeasibility masking to proactively steer the solution construction process. Moreover, we present PIP-D, which employs an auxiliary decoder and two adaptive strategies to learn and predict these tailored masks, potentially enhancing performance while significantly reducing computational costs during training. To verify our PIP designs, we conduct extensive experiments on the highly challenging Traveling Salesman Problem with Time Window (TSPTW), and TSP with Draft Limit (TSPDL) variants under different constraint hardness levels. Notably, our PIP is generic to boost many neural methods, and exhibits both a significant reduction in infeasible rate and a substantial improvement in solution quality.

Jiacheng Chen, Zeyuan Ma, Hongshu Guo et al.

Recent Meta-learning for Black-Box Optimization (MetaBBO) methods harness neural networks to meta-learn configurations of traditional black-box optimizers. Despite their success, they are inevitably restricted by the limitations of predefined hand-crafted optimizers. In this paper, we present \textsc{Symbol}, a novel framework that promotes the automated discovery of black-box optimizers through symbolic equation learning. Specifically, we propose a Symbolic Equation Generator (SEG) that allows closed-form optimization rules to be dynamically generated for specific tasks and optimization steps. Within \textsc{Symbol}, we then develop three distinct strategies based on reinforcement learning, so as to meta-learn the SEG efficiently. Extensive experiments reveal that the optimizers generated by \textsc{Symbol} not only surpass the state-of-the-art BBO and MetaBBO baselines, but also exhibit exceptional zero-shot generalization abilities across entirely unseen tasks with different problem dimensions, population sizes, and optimization horizons. Furthermore, we conduct in-depth analyses of our \textsc{Symbol} framework and the optimization rules that it generates, underscoring its desirable flexibility and interpretability.

Zeyuan Ma, Jiacheng Chen, Hongshu Guo et al.

Evolutionary computation (EC) algorithms, renowned as powerful black-box optimizers, leverage a group of individuals to cooperatively search for the optimum. The exploration-exploitation tradeoff (EET) plays a crucial role in EC, which, however, has traditionally been governed by manually designed rules. In this paper, we propose a deep reinforcement learning-based framework that autonomously configures and adapts the EET throughout the EC search process. The framework allows different individuals of the population to selectively attend to the global and local exemplars based on the current search state, maximizing the cooperative search outcome. Our proposed framework is characterized by its simplicity, effectiveness, and generalizability, with the potential to enhance numerous existing EC algorithms. To validate its capabilities, we apply our framework to several representative EC algorithms and conduct extensive experiments on the augmented CEC2021 benchmark. The results demonstrate significant improvements in the performance of the backbone algorithms, as well as favorable generalization across diverse problem classes, dimensions, and population sizes. Additionally, we provide an in-depth analysis of the EET issue by interpreting the learned behaviors of EC.

Yingpeng Du, Ziyan Wang, Zhu Sun et al.

In recent years, efforts have been made to use text information for better user profiling and item characterization in recommendations. However, text information can sometimes be of low quality, hindering its effectiveness for real-world applications. With knowledge and reasoning capabilities capsuled in Large Language Models (LLMs), utilizing LLMs emerges as a promising way for description improvement. However, existing ways of prompting LLMs with raw texts ignore structured knowledge of user-item interactions, which may lead to hallucination problems like inconsistent description generation. To this end, we propose a Graph-aware Convolutional LLM method to elicit LLMs to capture high-order relations in the user-item graph. To adapt text-based LLMs with structured graphs, We use the LLM as an aggregator in graph processing, allowing it to understand graph-based information step by step. Specifically, the LLM is required for description enhancement by exploring multi-hop neighbors layer by layer, thereby propagating information progressively in the graph. To enable LLMs to capture large-scale graph information, we break down the description task into smaller parts, which drastically reduces the context length of the token input with each step. Extensive experiments on three real-world datasets show that our method consistently outperforms state-of-the-art methods.

Hongshu Guo, Zeyuan Ma, Jiacheng Chen et al.

Recent advances in Meta-learning for Black-Box Optimization (MetaBBO) have shown the potential of using neural networks to dynamically configure evolutionary algorithms (EAs), enhancing their performance and adaptability across various BBO instances. However, they are often tailored to a specific EA, which limits their generalizability and necessitates retraining or redesigns for different EAs and optimization problems. To address this limitation, we introduce ConfigX, a new paradigm of the MetaBBO framework that is capable of learning a universal configuration agent (model) for boosting diverse EAs. To achieve so, our ConfigX first leverages a novel modularization system that enables the flexible combination of various optimization sub-modules to generate diverse EAs during training. Additionally, we propose a Transformer-based neural network to meta-learn a universal configuration policy through multitask reinforcement learning across a designed joint optimization task space. Extensive experiments verify that, our ConfigX, after large-scale pre-training, achieves robust zero-shot generalization to unseen tasks and outperforms state-of-the-art baselines. Moreover, ConfigX exhibits strong lifelong learning capabilities, allowing efficient adaptation to new tasks through fine-tuning. Our proposed ConfigX represents a significant step toward an automatic, all-purpose configuration agent for EAs.

Sirui Li, Wenbin Ouyang, Yining Ma et al.

Long-horizon combinatorial optimization problems (COPs), such as the Flexible Job-Shop Scheduling Problem (FJSP), often involve complex, interdependent decisions over extended time frames, posing significant challenges for existing solvers. While Rolling Horizon Optimization (RHO) addresses this by decomposing problems into overlapping shorter-horizon subproblems, such overlap often involves redundant computations. In this paper, we present L-RHO, the first learning-guided RHO framework for COPs. L-RHO employs a neural network to intelligently fix variables that in hindsight did not need to be re-optimized, resulting in smaller and thus easier-to-solve subproblems. For FJSP, this means identifying operations with unchanged machine assignments between consecutive subproblems. Applied to FJSP, L-RHO accelerates RHO by up to 54% while significantly improving solution quality, outperforming other heuristic and learning-based baselines. We also provide in-depth discussions and verify the desirable adaptability and generalization of L-RHO across numerous FJSP variates, distributions, online scenarios and benchmark instances. Moreover, we provide a theoretical analysis to elucidate the conditions under which learning is beneficial.

Wenbin Ouyang, Sirui Li, Yining Ma et al.

Iterative heuristics are widely recognized as state-of-the-art for Vehicle Routing Problems (VRPs). In this work, we exploit a critical observation: a large portion of the solution remains stable, i.e., unchanged across search iterations, causing redundant computations, especially for large-scale VRPs with long subtours. To address this, we pioneer the formal study of the First-Segment-Then-Aggregate (FSTA) decomposition technique to accelerate iterative solvers. FSTA preserves stable solution segments during the search, aggregates nodes within each segment into fixed hypernodes, and focuses the search only on unstable portions. Yet, a key challenge lies in identifying which segments should be aggregated. To this end, we introduce Learning-to-Segment (L2Seg), a novel neural framework to intelligently differentiate potentially stable and unstable portions for FSTA decomposition. We present three L2Seg variants: non-autoregressive (globally comprehensive but locally indiscriminate), autoregressive (locally refined but globally deficient), and their synergy. Empirical results on CVRP and VRPTW show that L2Seg accelerates state-of-the-art solvers by 2x to 7x. We further provide in-depth analysis showing why synergy achieves the best performance. Notably, L2Seg is compatible with traditional, learning-based, and hybrid solvers, while supporting various VRPs.

Yong Liang Goh, Zhiguang Cao, Yining Ma et al.

Recent advances toward foundation models for routing problems have shown great potential of a unified deep model for various VRP variants. However, they overlook the complex real-world customer distributions. In this work, we advance the Multi-Task VRP (MTVRP) setting to the more realistic yet challenging Multi-Task Multi-Distribution VRP (MTMDVRP) setting, and introduce SHIELD, a novel model that leverages both sparsity and hierarchy principles. Building on a deeper decoder architecture, we first incorporate the Mixture-of-Depths (MoD) technique to enforce sparsity. This improves both efficiency and generalization by allowing the model to dynamically select nodes to use or skip each decoder layer, providing the needed capacity to adaptively allocate computation for learning the task/distribution specific and shared representations. We also develop a context-based clustering layer that exploits the presence of hierarchical structures in the problems to produce better local representations. These two designs inductively bias the network to identify key features that are common across tasks and distributions, leading to significantly improved generalization on unseen ones. Our empirical results demonstrate the superiority of our approach over existing methods on 9 real-world maps with 16 VRP variants each.

Qi Li, Zhiguang Cao, Yining Ma et al.

Existing neural methods for the Travelling Salesman Problem (TSP) mostly aim at finding a single optimal solution. To discover diverse yet high-quality solutions for Multi-Solution TSP (MSTSP), we propose a novel deep reinforcement learning based neural solver, which is primarily featured by an encoder-decoder structured policy. Concretely, on the one hand, a Relativization Filter (RF) is designed to enhance the robustness of the encoder to affine transformations of the instances, so as to potentially improve the quality of the found solutions. On the other hand, a Multi-Attentive Adaptive Active Search (MA3S) is tailored to allow the decoders to strike a balance between the optimality and diversity. Experimental evaluations on benchmark instances demonstrate the superiority of our method over recent neural baselines across different metrics, and its competitive performance against state-of-the-art traditional heuristics with significantly reduced computational time, ranging from $1.3\times$ to $15\times$ faster. Furthermore, we demonstrate that our method can also be applied to the Capacitated Vehicle Routing Problem (CVRP).

Zhiqin Zhang, Yining Ma, Zhiguang Cao et al.

Neural combinatorial optimization (NCO) has achieved remarkable performance, yet its learned model representations and decision rationale remain a black box. This impedes both academic research and practical deployment, since researchers and stakeholders require deeper insights into NCO models. In this paper, we take the first critical step towards interpreting NCO models by investigating their representations through various probing tasks. Moreover, we introduce a novel probing tool named Coefficient Significance Probing (CS-Probing) to enable deeper analysis of NCO representations by examining the coefficients and statistical significance during probing. Extensive experiments and analysis reveal that NCO models encode low-level information essential for solution construction, while capturing high-level knowledge to facilitate better decisions. Using CS-Probing, we find that prevalent NCO models impose varying inductive biases on their learned representations, uncover direct evidence related to model generalization, and identify key embedding dimensions associated with specific knowledge. These insights can be potentially translated into practice, for example, with minor code modifications, we improve the generalization of the analyzed model. Our work represents a first systematic attempt to interpret black-box NCO models, showcasing probing as a promising tool for analyzing their internal mechanisms and revealing insights for the NCO community. The source code is publicly available.

Flint Xiaofeng Fan, Yining Ma, Zhongxiang Dai et al.

The growing literature of Federated Learning (FL) has recently inspired Federated Reinforcement Learning (FRL) to encourage multiple agents to federatively build a better decision-making policy without sharing raw trajectories. Despite its promising applications, existing works on FRL fail to I) provide theoretical analysis on its convergence, and II) account for random system failures and adversarial attacks. Towards this end, we propose the first FRL framework the convergence of which is guaranteed and tolerant to less than half of the participating agents being random system failures or adversarial attackers. We prove that the sample efficiency of the proposed framework is guaranteed to improve with the number of agents and is able to account for such potential failures or attacks. All theoretical results are empirically verified on various RL benchmark tasks.

Jingwen Li, Yining Ma, Ruize Gao et al.

Existing deep reinforcement learning (DRL) based methods for solving the capacitated vehicle routing problem (CVRP) intrinsically cope with homogeneous vehicle fleet, in which the fleet is assumed as repetitions of a single vehicle. Hence, their key to construct a solution solely lies in the selection of the next node (customer) to visit excluding the selection of vehicle. However, vehicles in real-world scenarios are likely to be heterogeneous with different characteristics that affect their capacity (or travel speed), rendering existing DRL methods less effective. In this paper, we tackle heterogeneous CVRP (HCVRP), where vehicles are mainly characterized by different capacities. We consider both min-max and min-sum objectives for HCVRP, which aim to minimize the longest or total travel time of the vehicle(s) in the fleet. To solve those problems, we propose a DRL method based on the attention mechanism with a vehicle selection decoder accounting for the heterogeneous fleet constraint and a node selection decoder accounting for the route construction, which learns to construct a solution by automatically selecting both a vehicle and a node for this vehicle at each step. Experimental results based on randomly generated instances show that, with desirable generalization to various problem sizes, our method outperforms the state-of-the-art DRL method and most of the conventional heuristics, and also delivers competitive performance against the state-of-the-art heuristic method, i.e., SISR. Additionally, the results of extended experiments demonstrate that our method is also able to solve CVRPLib instances with satisfactory performance.

Yining Ma, Jingwen Li, Zhiguang Cao et al.

Recently, Transformer has become a prevailing deep architecture for solving vehicle routing problems (VRPs). However, it is less effective in learning improvement models for VRP because its positional encoding (PE) method is not suitable in representing VRP solutions. This paper presents a novel Dual-Aspect Collaborative Transformer (DACT) to learn embeddings for the node and positional features separately, instead of fusing them together as done in existing ones, so as to avoid potential noises and incompatible correlations. Moreover, the positional features are embedded through a novel cyclic positional encoding (CPE) method to allow Transformer to effectively capture the circularity and symmetry of VRP solutions (i.e., cyclic sequences). We train DACT using Proximal Policy Optimization and design a curriculum learning strategy for better sample efficiency. We apply DACT to solve the traveling salesman problem (TSP) and capacitated vehicle routing problem (CVRP). Results show that our DACT outperforms existing Transformer based improvement models, and exhibits much better generalization performance across different problem sizes on synthetic and benchmark instances, respectively.