Qingfu Zhang

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.

Fu Luo, Xi Lin, Fei Liu et al.

Neural combinatorial optimization (NCO) is a promising learning-based approach for solving challenging combinatorial optimization problems without specialized algorithm design by experts. However, most constructive NCO methods cannot solve problems with large-scale instance sizes, which significantly diminishes their usefulness for real-world applications. In this work, we propose a novel Light Encoder and Heavy Decoder (LEHD) model with a strong generalization ability to address this critical issue. The LEHD model can learn to dynamically capture the relationships between all available nodes of varying sizes, which is beneficial for model generalization to problems of various scales. Moreover, we develop a data-efficient training scheme and a flexible solution construction mechanism for the proposed LEHD model. By training on small-scale problem instances, the LEHD model can generate nearly optimal solutions for the Travelling Salesman Problem (TSP) and the Capacitated Vehicle Routing Problem (CVRP) with up to 1000 nodes, and also generalizes well to solve real-world TSPLib and CVRPLib problems. These results confirm our proposed LEHD model can significantly improve the state-of-the-art performance for constructive NCO. The code is available at https://github.com/CIAM-Group/NCO_code/tree/main/single_objective/LEHD.

Fei Liu, Xi Lin, Zhenkun Wang et al.

Multiobjective evolutionary algorithms (MOEAs) are major methods for solving multiobjective optimization problems (MOPs). Many MOEAs have been proposed in the past decades, of which the search operators need a carefully handcrafted design with domain knowledge. Recently, some attempts have been made to replace the manually designed operators in MOEAs with learning-based operators (e.g., neural network models). However, much effort is still required for designing and training such models, and the learned operators might not generalize well on new problems. To tackle the above challenges, this work investigates a novel approach that leverages the powerful large language model (LLM) to design MOEA operators. With proper prompt engineering, we successfully let a general LLM serve as a black-box search operator for decomposition-based MOEA (MOEA/D) in a zero-shot manner. In addition, by learning from the LLM behavior, we further design an explicit white-box operator with randomness and propose a new version of decomposition-based MOEA, termed MOEA/D-LO. Experimental studies on different test benchmarks show that our proposed method can achieve competitive performance with widely used MOEAs. It is also promising to see the operator only learned from a few instances can have robust generalization performance on unseen problems with quite different patterns and settings. The results reveal the potential benefits of using pre-trained LLMs in the design of MOEAs.To foster reproducibility and accessibility, the source code is https://github.com/FeiLiu36/LLM4MOEA.

Xi Lin, Zhiyuan Yang, Qingfu Zhang

Multiobjective combinatorial optimization (MOCO) problems can be found in many real-world applications. However, exactly solving these problems would be very challenging, particularly when they are NP-hard. Many handcrafted heuristic methods have been proposed to tackle different MOCO problems over the past decades. In this work, we generalize the idea of neural combinatorial optimization, and develop a learning-based approach to approximate the whole Pareto set for a given MOCO problem without further search procedure. We propose a single preference-conditioned model to directly generate approximate Pareto solutions for any trade-off preference, and design an efficient multiobjective reinforcement learning algorithm to train this model. Our proposed method can be treated as a learning-based extension for the widely-used decomposition-based multiobjective evolutionary algorithm (MOEA/D). It uses a single model to accommodate all the possible preferences, whereas other methods use a finite number of solutions to approximate the Pareto set. Experimental results show that our proposed method significantly outperforms some other methods on the multiobjective traveling salesman problem, multiobjective vehicle routing problem, and multiobjective knapsack problem in terms of solution quality, speed, and model efficiency.

Xi Lin, Zhiyuan Yang, Xiaoyuan Zhang et al.

Expensive multi-objective optimization problems can be found in many real-world applications, where their objective function evaluations involve expensive computations or physical experiments. It is desirable to obtain an approximate Pareto front with a limited evaluation budget. Multi-objective Bayesian optimization (MOBO) has been widely used for finding a finite set of Pareto optimal solutions. However, it is well-known that the whole Pareto set is on a continuous manifold and can contain infinite solutions. The structural properties of the Pareto set are not well exploited in existing MOBO methods, and the finite-set approximation may not contain the most preferred solution(s) for decision-makers. This paper develops a novel learning-based method to approximate the whole Pareto set for MOBO, which generalizes the decomposition-based multi-objective optimization algorithm (MOEA/D) from finite populations to models. We design a simple and powerful acquisition search method based on the learned Pareto set, which naturally supports batch evaluation. In addition, with our proposed model, decision-makers can readily explore any trade-off area in the approximate Pareto set for flexible decision-making. This work represents the first attempt to model the Pareto set for expensive multi-objective optimization. Experimental results on different synthetic and real-world problems demonstrate the effectiveness of our proposed method.

Rui Zhang, Fei Liu, Xi Lin et al.

Automated heuristic design (AHD) has gained considerable attention for its potential to automate the development of effective heuristics. The recent advent of large language models (LLMs) has paved a new avenue for AHD, with initial efforts focusing on framing AHD as an evolutionary program search (EPS) problem. However, inconsistent benchmark settings, inadequate baselines, and a lack of detailed component analysis have left the necessity of integrating LLMs with search strategies and the true progress achieved by existing LLM-based EPS methods to be inadequately justified. This work seeks to fulfill these research queries by conducting a large-scale benchmark comprising four LLM-based EPS methods and four AHD problems across nine LLMs and five independent runs. Our extensive experiments yield meaningful insights, providing empirical grounding for the importance of evolutionary search in LLM-based AHD approaches, while also contributing to the advancement of future EPS algorithmic development. To foster accessibility and reproducibility, we have fully open-sourced our benchmark and corresponding results.

Xiaoyuan Zhang, Liang Zhao, Yingying Yu et al.

Multiobjective optimization problems (MOPs) are prevalent in machine learning, with applications in multi-task learning, learning under fairness or robustness constraints, etc. Instead of reducing multiple objective functions into a scalar objective, MOPs aim to optimize for the so-called Pareto optimality or Pareto set learning, which involves optimizing more than one objective function simultaneously, over models with thousands / millions of parameters. Existing benchmark libraries for MOPs mainly focus on evolutionary algorithms, most of which are zeroth-order / meta-heuristic methods that do not effectively utilize higher-order information from objectives and cannot scale to large-scale models with thousands / millions of parameters. In light of the above gap, this paper introduces LibMOON, the first multiobjective optimization library that supports state-of-the-art gradient-based methods, provides a fair benchmark, and is open-sourced for the community.

Fei Liu, Chengyu Lu, Lin Gui et al.

Vehicle routing is a well-known optimization research topic with significant practical importance. Among different approaches to solving vehicle routing, heuristics can produce a satisfactory solution at a reasonable computational cost. Consequently, much effort has been made in the past decades to develop vehicle routing heuristics. In this article, we systematically survey the existing vehicle routing heuristics, particularly on works carried out in recent years. A classification of vehicle routing heuristics is presented, followed by a review of their methodologies, recent developments, and applications. Moreover, we present a general framework of state-of-the-art methods and provide insights into their success. Finally, three emerging research topics with notable works and future directions are discussed.

Xi Lin, Zhiyuan Yang, Xiaoyuan Zhang et al.

Homotopy optimization is a traditional method to deal with a complicated optimization problem by solving a sequence of easy-to-hard surrogate subproblems. However, this method can be very sensitive to the continuation schedule design and might lead to a suboptimal solution to the original problem. In addition, the intermediate solutions, often ignored by classic homotopy optimization, could be useful for many real-world applications. In this work, we propose a novel model-based approach to learn the whole continuation path for homotopy optimization, which contains infinite intermediate solutions for any surrogate subproblems. Rather than the classic unidirectional easy-to-hard optimization, our method can simultaneously optimize the original problem and all surrogate subproblems in a collaborative manner. The proposed model also supports real-time generation of any intermediate solution, which could be desirable for many applications. Experimental studies on different problems show that our proposed method can significantly improve the performance of homotopy optimization and provide extra helpful information to support better decision-making.

Ping Guo, Tiantian Zhang, Xi Lin et al.

Personalized Federated Learning (PFL) aims to train customized models for clients with highly heterogeneous data distributions while preserving data privacy. Existing approaches often rely on heuristics like clustering or model interpolation, which lack principled mechanisms for balancing heterogeneous client objectives. Serving $M$ clients with distinct data distributions is inherently a multi-objective optimization problem, where achieving optimal personalization ideally requires $M$ distinct models on the Pareto front. However, maintaining $M$ separate models poses significant scalability challenges in federated settings with hundreds or thousands of clients. To address this challenge, we reformulate PFL as a few-for-many optimization problem that maintains only $K$ shared server models ($K \ll M$) to collectively serve all $M$ clients. We prove that this framework achieves near-optimal personalization: the approximation error diminishes as $K$ increases and each client's model converges to each client's optimum as data grows. Building on this reformulation, we propose FedFew, a practical algorithm that jointly optimizes the $K$ server models through efficient gradient-based updates. Unlike clustering-based approaches that require manual client partitioning or interpolation-based methods that demand careful hyperparameter tuning, FedFew automatically discovers the optimal model diversity through its optimization process. Experiments across vision, NLP, and real-world medical imaging datasets demonstrate that FedFew, with just 3 models, consistently outperforms other state-of-the-art approaches. Code is available at https://github.com/pgg3/FedFew.

Haokun Lin, Xinle Jia, Haobo Xu et al.

The MXFP4 microscaling format, which partitions tensors into blocks of 32 elements sharing an E8M0 scaling factor, has emerged as a promising substrate for efficient LLM inference, backed by native hardware support on NVIDIA Blackwell Tensor Cores. However, activation outliers pose a unique challenge under this format: a single outlier inflates the shared block scale, compressing the effective dynamic range of the remaining elements and causing significant quantization error. Existing rotation-based remedies, including randomized Hadamard and learnable rotations, are data-agnostic and therefore unable to specifically target the channels where outliers concentrate. We propose DuQuant++, which adapts the outlier-aware fine-grained rotation of DuQuant to the MXFP4 format by aligning the rotation block size with the microscaling group size (B{=}32). Because each MXFP4 group possesses an independent scaling factor, the cross-block variance issue that necessitates dual rotations and a zigzag permutation in the original DuQuant becomes irrelevant, enabling DuQuant++ to replace the entire pipeline with a single outlier-aware rotation, which halves the online rotation cost while simultaneously smoothing the weight distribution. Extensive experiments on the LLaMA-3 family under MXFP4 W4A4 quantization show that DuQuant++ consistently achieves state-of-the-art performance. Our code is available at https://github.com/Hsu1023/DuQuant-v2.

Fei Liu, Xialiang Tong, Mingxuan Yuan et al.

Optimization can be found in many real-life applications. Designing an effective algorithm for a specific optimization problem typically requires a tedious amount of effort from human experts with domain knowledge and algorithm design skills. In this paper, we propose a novel approach called Algorithm Evolution using Large Language Model (AEL). It utilizes a large language model (LLM) to automatically generate optimization algorithms via an evolutionary framework. AEL does algorithm-level evolution without model training. Human effort and requirements for domain knowledge can be significantly reduced. We take constructive methods for the salesman traveling problem as a test example, we show that the constructive algorithm obtained by AEL outperforms simple hand-crafted and LLM-generated heuristics. Compared with other domain deep learning model-based algorithms, these methods exhibit excellent scalability across different problem sizes. AEL is also very different from previous attempts that utilize LLMs as search operators in algorithms.

Shunyu Yao, Fei Liu, Xi Lin et al.

Heuristics are commonly used to tackle various search and optimization problems. Design heuristics usually require tedious manual crafting with domain knowledge. Recent works have incorporated Large Language Models (LLMs) into automatic heuristic search, leveraging their powerful language and coding capacity. However, existing research focuses on the optimal performance on the target problem as the sole objective, neglecting other criteria such as efficiency and scalability, which are vital in practice. To tackle this challenge, we propose to model the heuristic search as a multi-objective optimization problem and consider introducing additional practical criteria beyond optimal performance. Due to the complexity of the search space, conventional multi-objective optimization methods struggle to effectively handle LLM-based multi-objective heuristic search. We propose the first LLM-based multi-objective heuristic search framework, Multi-objective Evolution of Heuristic (MEoH), which integrates LLMs in a zero-shot manner to generate a non-dominated set of heuristics to meet multiple design criteria. We design a new dominance-dissimilarity mechanism for effective population management and selection, which incorporates both code dissimilarity in the search space and dominance in the objective space. MEoH is demonstrated in two well-known combinatorial optimization problems: the online Bin Packing Problem (BPP) and the Traveling Salesman Problem (TSP). The results indicate that a variety of elite heuristics are automatically generated in a single run, offering more trade-off options than the existing methods. It successfully achieves competitive or superior performance while improving efficiency up to 10 times. Moreover, we also observe that the multi-objective search introduces novel insights into heuristic design and leads to the discovery of diverse heuristics.

Junhao Qiu, Haoyang Zhuang, Fei Liu et al.

Dynamic flexible assembly flow shop scheduling with multi-product delivery is a critical combinatorial problem, characterized by kitting supply and machine flexibility. Genetic programming is widely used to automatically generate dispatching rules, enabling responsive scheduling that reduces manual effort while meeting high responsiveness demands. However, these methods are dependent on fixed terminal sets and have weak interpretability. In this article, we develop an evolving dispatching rules framework (EvoDR) that leverages the semantic understanding and generation capabilities of large language models to achieve cross-domain integration of algorithm design and scheduling knowledge. Firstly, multi-stage assembly supply decisions are modeled as priority sorting of directed edges based on heterogeneous graphs. A dual-expert co-evolution mechanism is implemented, where LLM-A generates code while LLM-S conducts scheduling analysis and reflection. Guided by improvements in hybrid evaluation, adaptive rules that fit dynamic features are continuously evolved. Experimental results show that the EvoDR achieves lower average tardiness than state-of-the-art approaches. In 24 scenarios with different resource configurations and disturbance levels totaling 480 instances, it consistently outperforms expert-designed competitors, demonstrating superior robustness.

Fei Liu, Xi Lin, Zhenkun Wang et al.

Vehicle routing problems (VRPs), which can be found in numerous real-world applications, have been an important research topic for several decades. Recently, the neural combinatorial optimization (NCO) approach that leverages a learning-based model to solve VRPs without manual algorithm design has gained substantial attention. However, current NCO methods typically require building one model for each routing problem, which significantly hinders their practical application for real-world industry problems with diverse attributes. In this work, we make the first attempt to tackle the crucial challenge of cross-problem generalization. In particular, we formulate VRPs as different combinations of a set of shared underlying attributes and solve them simultaneously via a single model through attribute composition. In this way, our proposed model can successfully solve VRPs with unseen attribute combinations in a zero-shot generalization manner. Extensive experiments are conducted on eleven VRP variants, benchmark datasets, and industry logistic scenarios. The results show that the unified model demonstrates superior performance in the eleven VRPs, reducing the average gap to around 5% from over 20% in the existing approach and achieving a significant performance boost on benchmark datasets as well as a real-world logistics application. The source code is included in https://github.com/FeiLiu36/MTNCO.

Yunpeng Ba, Xi Lin, Changliang Zhou et al.

Neural routing solvers (NRSs) that leverage deep learning to tackle vehicle routing problems have demonstrated notable potential for practical applications. By learning implicit heuristic rules from data, NRSs replace the handcrafted counterparts in classic heuristic frameworks, thereby reducing reliance on costly manual design and trial-and-error adjustments. This survey makes two main contributions: (1) The heuristic nature of NRSs is highlighted, and existing NRSs are reviewed from the perspective of heuristics. A hierarchical taxonomy based on heuristic principles is further introduced. (2) A generalization-focused evaluation pipeline is proposed to address limitations of the conventional pipeline. Comparative benchmarking of representative NRSs across both pipelines uncovers a series of previously unreported gaps in current research.

Haokun Lin, Teng Wang, Yixiao Ge et al.

Pioneering token-based works such as Chameleon and Emu3 have established a foundation for multimodal unification but face challenges of high training computational overhead and limited comprehension performance due to a lack of high-level semantics. In this paper, we introduce TokLIP, a visual tokenizer that enhances comprehension by semanticizing vector-quantized (VQ) tokens and incorporating CLIP-level semantics while enabling end-to-end multimodal autoregressive training with standard VQ tokens. TokLIP integrates a low-level discrete VQ tokenizer with a ViT-based token encoder to capture high-level continuous semantics. Unlike previous approaches (e.g., VILA-U) that discretize high-level features, TokLIP disentangles training objectives for comprehension and generation, allowing the direct application of advanced VQ tokenizers without the need for tailored quantization operations. Our empirical results demonstrate that TokLIP achieves exceptional data efficiency, empowering visual tokens with high-level semantic understanding while enhancing low-level generative capacity, making it well-suited for autoregressive Transformers in both comprehension and generation tasks. The code and models are available at https://github.com/TencentARC/TokLIP.

Weiyu Chen, Baijiong Lin, Xiaoyuan Zhang et al.

Many modern deep learning applications require balancing multiple objectives that are often conflicting. Examples include multi-task learning, fairness-aware learning, and the alignment of Large Language Models (LLMs). This leads to multi-objective deep learning, which tries to find optimal trade-offs or Pareto-optimal solutions by adapting mathematical principles from the field of Multi-Objective Optimization (MOO). However, directly applying gradient-based MOO techniques to deep neural networks presents unique challenges, including high computational costs, optimization instability, and the difficulty of effectively incorporating user preferences. This paper provides a comprehensive survey of gradient-based techniques for multi-objective deep learning. We systematically categorize existing algorithms based on their outputs: (i) methods that find a single, well-balanced solution, (ii) methods that generate a finite set of diverse Pareto-optimal solutions, and (iii) methods that learn a continuous Pareto set of solutions. In addition to this taxonomy, the survey covers theoretical analyses, key applications, practical resources, and highlights open challenges and promising directions for future research. A comprehensive list of multi-objective deep learning algorithms is available at https://github.com/Baijiong-Lin/Awesome-Multi-Objective-Deep-Learning.

Dake Bu, Wei Huang, Andi Han et al.

Diffusion language models generate without a fixed left-to-right order, making token ordering a central algorithmic choice: which tokens should be revealed, retained, revised or verified at each step? Existing systems mainly use random masking or confidence-driven ordering. Random masking creates train--test mismatch, while confidence-only rules are efficient but can be myopic and suppress useful exploration. We introduce DPRM (Doob h-transform Process Reward Model), a plug-in token-ordering module for diffusion language models. DPRM keeps the host architecture, denoising objective and supervision unchanged, and changes only the ordering policy. It starts from confidence-driven progressive ordering and gradually shifts to Doob h transform Process Reward guided ordering through online estimates. We characterize the exact DPRM policy as a reward-tilted Gibbs reveal law, prove O(1/N) convergence of the stagewise Soft-BoN approximation, and show that the online bucketized controller tracks the exact DPRM score at empirical-Bernstein rates. Under tractable optimization assumptions, DPRM also yields a sample-complexity advantage over random and confidence-only ordering. DPRM improves over confidence-based baselines in pretraining, post-training, test-time scaling, and single-cell masked diffusion, with particularly strong gains on harder reasoning subsets. In protein, molecular generation and DNA design, the effect is more multi-objective: ordering-aware variants significantly improve selected structural or fragment-constrained metrics while not uniformly dominating the host baseline on every quality metric. These results identify token ordering as a fundamental control axis in diffusion language models and establish DPRM as a general-purpose module for improving it. Code is available at https://github.com/DakeBU/DPRM-DLLM.

Zhuoliang Xie, Fei Liu, Zhenkun Wang et al.

The Capacitated Vehicle Routing Problem (CVRP), a fundamental combinatorial optimization challenge, focuses on optimizing fleet operations under vehicle capacity constraints. While extensively studied in operational research, the NP-hard nature of CVRP continues to pose significant computational challenges, particularly for large-scale instances. This study presents AILS-AHD (Adaptive Iterated Local Search with Automatic Heuristic Design), a novel approach that leverages Large Language Models (LLMs) to revolutionize CVRP solving. Our methodology integrates an evolutionary search framework with LLMs to dynamically generate and optimize ruin heuristics within the AILS method. Additionally, we introduce an LLM-based acceleration mechanism to enhance computational efficiency. Comprehensive experimental evaluations against state-of-the-art solvers, including AILS-II and HGS, demonstrate the superior performance of AILS-AHD across both moderate and large-scale instances. Notably, our approach establishes new best-known solutions for 8 out of 10 instances in the CVRPLib large-scale benchmark, underscoring the potential of LLM-driven heuristic design in advancing the field of vehicle routing optimization.

Xiaoyuan Zhang, Xi Lin, Qingfu Zhang

It is desirable in many multi-objective machine learning applications, such as multi-task learning with conflicting objectives and multi-objective reinforcement learning, to find a Pareto solution that can match a given preference of a decision maker. These problems are often large-scale with available gradient information but cannot be handled very well by the existing algorithms. To tackle this critical issue, this paper proposes a novel predict-and-correct framework for locating a Pareto solution that fits the preference of a decision maker. In the proposed framework, a constraint function is introduced in the search progress to align the solution with a user-specific preference, which can be optimized simultaneously with multiple objective functions. Experimental results show that our proposed method can efficiently find a particular Pareto solution under the demand of a decision maker for standard multiobjective benchmark, multi-task learning, and multi-objective reinforcement learning problems with more than thousands of decision variables. Code is available at: https://github.com/xzhang2523/pmgda. Our code is current provided in the pgmda.rar attached file and will be open-sourced after publication.}

Dake Bu, Wei Huang, Andi Han et al.

Recent curriculum techniques in the post-training stage of LLMs have been widely observed to outperform non-curriculum approaches in enhancing reasoning performance, yet a principled understanding of why and to what extent they work remains elusive. To address this gap, we develop a theoretical framework grounded in the intuition that progressively learning through manageable steps is more efficient than directly tackling a hard reasoning task, provided each stage stays within the model's effective competence. Under mild complexity conditions linking consecutive curriculum stages, we show that curriculum post-training avoids the exponential complexity bottleneck. To substantiate this result, drawing insights from the Chain-of-Thoughts (CoTs) solving mathematical problems such as Countdown and parity, we model CoT generation as a states-conditioned autoregressive reasoning tree, define a uniform-branching base model to capture pretrained behavior, and formalize curriculum stages as either depth-increasing (longer reasoning chains) or hint-decreasing (shorter prefixes) subtasks. Our analysis shows that, under outcome-only reward signals, reinforcement learning finetuning achieves high accuracy with polynomial sample complexity, whereas direct learning suffers from an exponential bottleneck. We further establish analogous guarantees for test-time scaling, where curriculum-aware querying reduces both reward oracle calls and sampling cost from exponential to polynomial order.

Dake Bu, Wei Huang, Andi Han et al.

Foundation models exhibit broad knowledge but limited task-specific reasoning, motivating post-training strategies such as RLVR and inference scaling with outcome or process reward models (ORM/PRM). While recent work highlights the role of exploration and entropy stability in improving pass@K, empirical evidence points to a paradox: RLVR and ORM/PRM typically reinforce existing tree-like reasoning paths rather than expanding the reasoning scope, raising the question of why exploration helps at all if no new patterns emerge. To reconcile this paradox, we adopt the perspective of Kim et al. (2025), viewing easy (e.g., simplifying a fraction) versus hard (e.g., discovering a symmetry) reasoning steps as low- versus high-probability Markov transitions, and formalize post-training dynamics through Multi-task Tree-structured Markov Chains (TMC). In this tractable model, pretraining corresponds to tree expansion, while post-training corresponds to chain-of-thought reweighting. We show that several phenomena recently observed in empirical studies arise naturally in this setting: (1) RLVR induces a squeezing effect, reducing reasoning entropy and forgetting some correct paths; (2) population rewards of ORM/PRM encourage consistency rather than accuracy, thereby favoring common patterns; and (3) certain rare, high-uncertainty reasoning paths by the base model are responsible for solving hard problem instances. Together, these explain why exploration -- even when confined to the base model's reasoning scope -- remains essential: it preserves access to rare but crucial reasoning traces needed for difficult cases, which are squeezed out by RLVR or unfavored by inference scaling. Building on this, we further show that exploration strategies such as rejecting easy instances and KL regularization help preserve rare reasoning traces. Empirical simulations corroborate our theoretical results.

Shen-Huan Lyu, Rong-Xi Tan, Ke Xue et al.

Offline model-based optimization (MBO) seeks to discover high-performing designs using only a fixed dataset of past evaluations. Most existing methods rely on learning a surrogate model via regression and implicitly assume that good predictive accuracy leads to good optimization performance. In this work, we challenge this assumption and study offline MBO from a learnability perspective. We argue that offline optimization is fundamentally a problem of ranking high-quality designs rather than accurate value prediction. Specifically, we introduce an optimization-oriented risk based on ranking between near-optimal and suboptimal designs, and develop a unified theoretical framework that connects surrogate learning to final optimization. We prove the theoretical advantages of ranking over regression, and identify distributional mismatch between the training data and near-optimal designs as the dominant error. Inspired by this, we design a distribution-aware ranking method to reduce this mismatch. Empirical results across various tasks show that our approach outperforms twenty existing methods, validating our theoretical findings. Additionally, both theoretical and empirical results reveal intrinsic limitations in offline MBO, showing a regime in which no offline method can avoid over-optimistic extrapolation.

Haokun Lin, Haobo Xu, Yichen Wu et al.

Recent advances in diffusion large language models (dLLMs) have introduced a promising alternative to autoregressive (AR) LLMs for natural language generation tasks, leveraging full attention and denoising-based decoding strategies. However, the deployment of these models on edge devices remains challenging due to their massive parameter scale and high resource demands. While post-training quantization (PTQ) has emerged as a widely adopted technique for compressing AR LLMs, its applicability to dLLMs remains largely unexplored. In this work, we present the first systematic study on quantizing diffusion-based language models. We begin by identifying the presence of activation outliers, characterized by abnormally large activation values that dominate the dynamic range. These outliers pose a key challenge to low-bit quantization, as they make it difficult to preserve precision for the majority of values. More importantly, we implement state-of-the-art PTQ methods and conduct a comprehensive evaluation across multiple task types and model variants. Our analysis is structured along four key dimensions: bit-width, quantization method, task category, and model type. Through this multi-perspective evaluation, we offer practical insights into the quantization behavior of dLLMs under different configurations. We hope our findings provide a foundation for future research in efficient dLLM deployment. Our code is publicly available at https://github.com/FelixMessi/QDLM.

Fei Liu, Xi Lin, Weiduo Liao et al.

Neural combinatorial optimization (NCO) is a promising learning-based approach to solving various vehicle routing problems without much manual algorithm design. However, the current NCO methods mainly focus on the in-distribution performance, while the real-world problem instances usually come from different distributions. A costly fine-tuning approach or generalized model retraining from scratch could be needed to tackle the out-of-distribution instances. Unlike the existing methods, this work investigates an efficient prompt learning approach in NCO for cross-distribution adaptation. To be concrete, we propose a novel prompt learning method to facilitate fast zero-shot adaptation of a pre-trained model to solve routing problem instances from different distributions. The proposed model learns a set of prompts among various distributions and then selects the best-matched one to prompt a pre-trained attention model for each problem instance. Extensive experiments show that the proposed prompt learning approach facilitates the fast adaptation of pre-trained routing models. It also outperforms existing generalized models on both in-distribution prediction and zero-shot generalization to a diverse set of new tasks. Our code implementation is available online https://github.com/FeiLiu36/PromptVRP.

Wei Wang, Jialong Shi, Jianyong Sun et al.

The hardness of the Unconstrained Binary Quadratic Program (UBQP) problem is due its rugged landscape. Various algorithms have been proposed for UBQP, including the Landscape Smoothing Iterated Local Search (LSILS). Different from other UBQP algorithms, LSILS tries to smooth the rugged landscape by building a convex combination of the original UBQP and a toy UBQP. In this paper, our study further investigates the impact of smoothing rugged landscapes using different toy UBQP problems, including a toy UBQP with matrix ^Q1 (construct by "+/-1"), a toy UBQP with matrix ^Q2 (construct by "+/-i") and a toy UBQP with matrix ^Q3 (construct randomly). We first assess the landscape flatness of the three toy UBQPs. Subsequently, we test the efficiency of LSILS with different toy UBQPs. Results reveal that the toy UBQP with ^Q1 (construct by "+/-1") exhibits the flattest landscape among the three, while the toy UBQP with ^Q3 (construct randomly) presents the most non-flat landscape. Notably, LSILS using the toy UBQP with ^Q2 (construct by "+/-i") emerges as the most effective, while ^Q3 (construct randomly) has the poorest result. These findings contribute to a detailed understanding of landscape smoothing techniques in optimizing UBQP.

Gan Zheng, Fei Liu, Qingfu Zhang

Fluid antenna is a new reconfigurable antenna technology that can dynamically adjust the positions or ports of radiating elements and therefore provides a new degree of freedom for wireless communications. However, the associated port selection is a challenging large-scale combinatorial optimization problem and difficult to solve. Existing manually designed heuristic algorithms are not only labor-intensive, but cannot achieve satisfactory performance. In this paper, we propose a novel paradigm that leverages large language models (LLMs) for automated design of optimization algorithms for fluid antenna systems without manual hyperheuristic tuning. Specifically, we study the problem of maximizing the minimum signal-to-interference-plus-noise ratio (SINR) in the downlink to ensure fairness among users by optimizing port selection and beamforming. We investigate two LLM-enabled algorithm optimization strategies. The first is to optimize the crossover and mutation operations to enhance the performance of the well-known genetic algorithm and the second is to design AutoPort, a new heuristic from scratch by LLM, to solve the optimization problem. Simulation results verify that the proposed method can achieve near-optimal performance and significant improvement over the conventional genetic algorithm and the deep learning approach.

Jiahuan Jin, Wenhao Zhao, Rong Qu et al.

Multi-objective optimization (MOO) has been widely studied in literature because of its versatility in human-centered decision making in real-life applications. Recently, demand for dynamic MOO is fast-emerging due to tough market dynamics that require real-time re-adjustments of priorities for different objectives. However, most existing studies focus either on deterministic MOO problems which are not practical, or non-sequential dynamic MOO decision problems that cannot deal with some real-life complexities. To address these challenges, a preference-agile multi-objective optimization (PAMOO) is proposed in this paper to permit users to dynamically adjust and interactively assign the preferences on the fly. To achieve this, a novel uniform model within a deep reinforcement learning (DRL) framework is proposed that can take as inputs users' dynamic preference vectors explicitly. Additionally, a calibration function is fitted to ensure high quality alignment between the preference vector inputs and the output DRL decision policy. Extensive experiments on challenging real-life vehicle dispatching problems at a container terminal showed that PAMOO obtains superior performance and generalization ability when compared with two most popular MOO methods. Our method presents the first dynamic MOO method for challenging \rev{dynamic sequential MOO decision problems

Ping Guo, Qingfu Zhang, Xi Lin

The discovery of symbolic solutions -- mathematical expressions, logical rules, and algorithmic structures -- is fundamental to advancing scientific and engineering progress. However, traditional methods often struggle with search efficiency and fail to integrate knowledge effectively. While recent large language model-based (LLM-based) approaches have demonstrated improvements in search efficiency, they lack the ability to continually refine and expand upon discovered solutions and their underlying knowledge, limiting their potential for open-ended innovation. To address these limitations, we introduce CoEvo, a novel framework that leverages large language models within an evolutionary search methodology to continually generate and refine symbolic solutions. CoEvo integrates a dynamic knowledge library, enabling open-ended innovation of solutions through effective knowledge management. Additionally, CoEvo leverages multiple representations of solutions -- including natural language, mathematical expressions, and code -- to further enhance search efficiency. By combining the reasoning capabilities of LLMs with the exploratory power of evolutionary algorithms, CoEvo significantly improves the efficiency and scope of symbolic discovery. Our experimental results demonstrate that this method not only enhances the efficiency of searching for symbolic solutions but also supports the ongoing discovery process, akin to human scientific endeavors. This study represents a first effort in conceptualizing the search for symbolic solutions as a lifelong, iterative process, marking a significant step towards harnessing LLMs in the perpetual pursuit of scientific and engineering breakthroughs. Our code is available at https://github.com/pgg3/CoEvo.

Changliang Zhou, Xi Lin, Zhenkun Wang et al.

The neural combinatorial optimization (NCO) method has shown great potential for solving routing problems of intelligent transportation systems without requiring expert knowledge. However, existing constructive NCO methods still struggle to solve large-scale instances, which significantly limits their application prospects. To address these crucial shortcomings, this work proposes a novel Instance-Conditioned Adaptation Model (ICAM) for better large-scale generalization of neural routing solvers. In particular, we design a simple yet efficient instance-conditioned adaptation function to significantly improve the generalization performance of existing NCO models with a small time and memory overhead. In addition, with a systematic investigation on the performance of information incorporation between different attention mechanisms, we further propose a powerful yet low-complexity instance-conditioned adaptation module to generate better solutions for instances across different scales. Extensive experimental results on both synthetic and benchmark instances show that our proposed method is capable of obtaining promising results with a very fast inference time in solving large-scale Traveling Salesman Problems (TSPs), Capacitated Vehicle Routing Problems (CVRPs), and Asymmetric Traveling Salesman Problems (ATSPs). Our code is available at https://github.com/CIAM-Group/ICAM.

Bo Xue, Yuanyu Wan, Zhichao Lu et al.

In multi-objective decision-making with hierarchical preferences, lexicographic bandits provide a natural framework for optimizing multiple objectives in a prioritized order. In this setting, a learner repeatedly selects arms and observes reward vectors, aiming to maximize the reward for the highest-priority objective, then the next, and so on. While previous studies have primarily focused on regret minimization, this work bridges the gap between \textit{regret minimization} and \textit{best arm identification} under lexicographic preferences. We propose two elimination-based algorithms to address this joint objective. The first algorithm eliminates suboptimal arms sequentially, layer by layer, in accordance with the objective priorities, and achieves sample complexity and regret bounds comparable to those of the best single-objective algorithms. The second algorithm simultaneously leverages reward information from all objectives in each round, effectively exploiting cross-objective dependencies. Remarkably, it outperforms the known lower bound for the single-objective bandit problem, highlighting the benefit of cross-objective information sharing in the multi-objective setting. Empirical results further validate their superior performance over baselines.

Zhe Zhao, Haibin Wen, Jiaming Ma et al.

An important recurring pattern in scientific breakthroughs is a two-stage process: an initial phase of undirected experimentation that yields an unexpected finding, followed by a retrospective phase that explains why the finding works and situates it within existing theory. We present ResearchEVO, an end-to-end framework that computationally instantiates this discover-then-explain paradigm. The Evolution Phase employs LLM-guided bi-dimensional co-evolution -- simultaneously optimizing both algorithmic logic and overall architecture -- to search the space of code implementations purely by fitness, without requiring any understanding of the solutions it produces. The Writing Phase then takes the best-performing algorithm and autonomously generates a complete, publication-ready research paper through sentence-level retrieval-augmented generation with explicit anti-hallucination verification and automated experiment design. To our knowledge, ResearchEVO is the first system to cover this full pipeline end to end: no prior work jointly performs principled algorithm evolution and literature-grounded scientific documentation. We validate the framework on two cross-disciplinary scientific problems -- Quantum Error Correction using real Google quantum hardware data, and Physics-Informed Neural Networks -- where the Evolution Phase discovered human-interpretable algorithmic mechanisms that had not been previously proposed in the respective domain literatures. In both cases, the Writing Phase autonomously produced compilable LaTeX manuscripts that correctly grounded these blind discoveries in existing theory via RAG, with zero fabricated citations.

Xiaoyuan Zhang, Xi Lin, Yichi Zhang et al.

Multiobjective optimization (MOO) is prevalent in numerous applications, in which a Pareto front (PF) is constructed to display optima under various preferences. Previous methods commonly utilize the set of Pareto objectives (particles on the PF) to represent the entire PF. However, the empirical distribution of the Pareto objectives on the PF is rarely studied, which implicitly impedes the generation of diverse and representative Pareto objectives in previous methods. To bridge the gap, we suggest in this paper constructing \emph{uniformly distributed} Pareto objectives on the PF, so as to alleviate the limited diversity found in previous MOO approaches. We are the first to formally define the concept of ``uniformity" for an MOO problem. We optimize the maximal minimal distances on the Pareto front using a neural network, resulting in both asymptotically and non-asymptotically uniform Pareto objectives. Our proposed method is validated through experiments on real-world and synthetic problems, which demonstrates the efficacy in generating high-quality uniform Pareto objectives and the encouraging performance exceeding existing state-of-the-art methods. The detailed model implementation and the code are scheduled to be open-sourced upon publication.

Fei Liu, Xialiang Tong, Mingxuan Yuan et al.

Heuristics are widely used for dealing with complex search and optimization problems. However, manual design of heuristics can be often very labour extensive and requires rich working experience and knowledge. This paper proposes Evolution of Heuristic (EoH), a novel evolutionary paradigm that leverages both Large Language Models (LLMs) and Evolutionary Computation (EC) methods for Automatic Heuristic Design (AHD). EoH represents the ideas of heuristics in natural language, termed thoughts. They are then translated into executable codes by LLMs. The evolution of both thoughts and codes in an evolutionary search framework makes it very effective and efficient for generating high-performance heuristics. Experiments on three widely studied combinatorial optimization benchmark problems demonstrate that EoH outperforms commonly used handcrafted heuristics and other recent AHD methods including FunSearch. Particularly, the heuristic produced by EoH with a low computational budget (in terms of the number of queries to LLMs) significantly outperforms widely-used human hand-crafted baseline algorithms for the online bin packing problem.

Ping Guo, Cheng Gong, Xi Lin et al.

Crafting adversarial examples is crucial for evaluating and enhancing the robustness of Deep Neural Networks (DNNs), presenting a challenge equivalent to maximizing a non-differentiable 0-1 loss function. However, existing single objective methods, namely adversarial attacks focus on a surrogate loss function, do not fully harness the benefits of engaging multiple loss functions, as a result of insufficient understanding of their synergistic and conflicting nature. To overcome these limitations, we propose the Multi-Objective Set-based Attack (MOS Attack), a novel adversarial attack framework leveraging multiple loss functions and automatically uncovering their interrelations. The MOS Attack adopts a set-based multi-objective optimization strategy, enabling the incorporation of numerous loss functions without additional parameters. It also automatically mines synergistic patterns among various losses, facilitating the generation of potent adversarial attacks with fewer objectives. Extensive experiments have shown that our MOS Attack outperforms single-objective attacks. Furthermore, by harnessing the identified synergistic patterns, MOS Attack continues to show superior results with a reduced number of loss functions. Our code is available at https://github.com/pgg3/MOS-Attack.

Zhiyu Zhu, Hui Liu, Junhui Hou et al.

This paper investigates the problem of reconstructing hyperspectral (HS) images from single RGB images captured by commercial cameras, \textbf{without} using paired HS and RGB images during training. To tackle this challenge, we propose a new lightweight and end-to-end learning-based framework. Specifically, on the basis of the intrinsic imaging degradation model of RGB images from HS images, we progressively spread the differences between input RGB images and re-projected RGB images from recovered HS images via effective unsupervised camera spectral response function estimation. To enable the learning without paired ground-truth HS images as supervision, we adopt the adversarial learning manner and boost it with a simple yet effective $\mathcal{L}_1$ gradient clipping scheme. Besides, we embed the semantic information of input RGB images to locally regularize the unsupervised learning, which is expected to promote pixels with identical semantics to have consistent spectral signatures. In addition to conducting quantitative experiments over two widely-used datasets for HS image reconstruction from synthetic RGB images, we also evaluate our method by applying recovered HS images from real RGB images to HS-based visual tracking. Extensive results show that our method significantly outperforms state-of-the-art unsupervised methods and even exceeds the latest supervised method under some settings. The source code is public available at https://github.com/zbzhzhy/Unsupervised-Spectral-Reconstruction.

Zhiyu Zhu, Hui Liu, Junhui Hou et al.

This paper investigates the problem of recovering hyperspectral (HS) images from single RGB images. To tackle such a severely ill-posed problem, we propose a physically-interpretable, compact, efficient, and end-to-end learning-based framework, namely AGD-Net. Precisely, by taking advantage of the imaging process, we first formulate the problem explicitly based on the classic gradient descent algorithm. Then, we design a lightweight neural network with a multi-stage architecture to mimic the formed amended gradient descent process, in which efficient convolution and novel spectral zero-mean normalization are proposed to effectively extract spatial-spectral features for regressing an initialization, a basic gradient, and an incremental gradient. Besides, based on the approximate low-rank property of HS images, we propose a novel rank loss to promote the similarity between the global structures of reconstructed and ground-truth HS images, which is optimized with our singular value weighting strategy during training. Moreover, AGD-Net, a single network after one-time training, is flexible to handle the reconstruction with various spectral response functions. Extensive experiments over three commonly-used benchmark datasets demonstrate that AGD-Net can improve the reconstruction quality by more than 1.0 dB on average while saving 67$\times$ parameters and 32$\times$ FLOPs, compared with state-of-the-art methods. The code will be publicly available at https://github.com/zbzhzhy/GD-Net.

Yuheng Jia, Hui Liu, Junhui Hou et al.

Symmetric nonnegative matrix factorization (SNMF) has demonstrated to be a powerful method for data clustering. However, SNMF is mathematically formulated as a non-convex optimization problem, making it sensitive to the initialization of variables. Inspired by ensemble clustering that aims to seek a better clustering result from a set of clustering results, we propose self-supervised SNMF (S$^3$NMF), which is capable of boosting clustering performance progressively by taking advantage of the sensitivity to initialization characteristic of SNMF, without relying on any additional information. Specifically, we first perform SNMF repeatedly with a random nonnegative matrix for initialization each time, leading to multiple decomposed matrices. Then, we rank the quality of the resulting matrices with adaptively learned weights, from which a new similarity matrix that is expected to be more discriminative is reconstructed for SNMF again. These two steps are iterated until the stopping criterion/maximum number of iterations is achieved. We mathematically formulate S$^3$NMF as a constraint optimization problem, and provide an alternative optimization algorithm to solve it with the theoretical convergence guaranteed. Extensive experimental results on $10$ commonly used benchmark datasets demonstrate the significant advantage of our S$^3$NMF over $12$ state-of-the-art methods in terms of $5$ quantitative metrics. The source code is publicly available at https://github.com/jyh-learning/SSSNMF.

Yu-Nian Wang, Shen-Huan Lyu, Ning Chen et al.

With the rapid advancement of large language models (LLMs), LLM-based heuristic search methods have demonstrated strong capabilities in automated algorithm generation. However, their evolutionary processes often suffer from instability and premature convergence. Existing approaches mainly address this issue through prompt engineering or by jointly evolving thought and code, while largely overlooking the critical role of algorithmic category diversity in maintaining evolutionary stability. To this end, we propose Category Driven Automatic Algorithm Design with Large Language Models (CDEoH), which explicitly models algorithm categories and jointly balances performance and category diversity in population management, enabling parallel exploration across multiple algorithmic paradigms. Extensive experiments on representative combinatorial optimization problems across multiple scales demonstrate that CDEoH effectively mitigates convergence toward a single evolutionary direction, significantly enhancing evolutionary stability and achieving consistently superior average performance across tasks and scales.

Tian-Shuang Wu, Shen-Huan Lyu, Ning Chen et al.

Local class imbalance and data heterogeneity across clients often trap prototype-based federated contrastive learning in a prototype bias loop: biased local prototypes induced by imbalanced data are aggregated into biased global prototypes, which are repeatedly reused as contrastive anchors, accumulating errors across communication rounds. To break this loop, we propose Confidence-Aware Federated Contrastive Learning (CAFedCL), a novel framework that improves the prototype aggregation mechanism and strengthens the contrastive alignment guided by prototypes. CAFedCL employs a confidence-aware aggregation mechanism that leverages predictive uncertainty to downweight high-variance local prototypes. In addition, generative augmentation for minority classes and geometric consistency regularization are integrated to stabilize the structure between classes. From a theoretical perspective, we provide an expectation-based analysis showing that our aggregation reduces estimation variance, thereby bounding global prototype drift and ensuring convergence. Extensive experiments under varying levels of class imbalance and data heterogeneity demonstrate that CAFedCL consistently outperforms representative federated baselines in both accuracy and client fairness.

Yifan Zhong, Chengdong Ma, Xiaoyuan Zhang et al.

Current methods for large language model alignment typically use scalar human preference labels. However, this convention tends to oversimplify the multi-dimensional and heterogeneous nature of human preferences, leading to reduced expressivity and even misalignment. This paper presents Panacea, an innovative approach that reframes alignment as a multi-dimensional preference optimization problem. Panacea trains a single model capable of adapting online and Pareto-optimally to diverse sets of preferences without the need for further tuning. A major challenge here is using a low-dimensional preference vector to guide the model's behavior, despite it being governed by an overwhelmingly large number of parameters. To address this, Panacea is designed to use singular value decomposition (SVD)-based low-rank adaptation, which allows the preference vector to be simply injected online as singular values. Theoretically, we prove that Panacea recovers the entire Pareto front with common loss aggregation methods under mild conditions. Moreover, our experiments demonstrate, for the first time, the feasibility of aligning a single LLM to represent an exponentially vast spectrum of human preferences through various optimization methods. Our work marks a step forward in effectively and efficiently aligning models to diverse and intricate human preferences in a controllable and Pareto-optimal manner.

Fei Liu, Yiming Yao, Ping Guo et al.

Algorithm Design (AD) is crucial for effective problem-solving across various domains. The advent of Large Language Models (LLMs) has notably enhanced the automation and innovation within this field, offering new perspectives and promising solutions. Over the past three years, the integration of LLMs into AD (LLM4AD) has seen substantial progress, with applications spanning optimization, machine learning, mathematical reasoning, and scientific discovery. Given the rapid advancements and expanding scope of this field, a systematic review is both timely and necessary. This paper provides a systematic review of LLM4AD. First, we offer an overview and summary of existing studies. Then, we introduce a taxonomy and review the literature across four dimensions: the roles of LLMs, search methods, prompt methods, and application domains with a discussion of potential and achievements of LLMs in AD. Finally, we identify current challenges and highlight several promising directions for future research.

Xi Lin, Xiaoyuan Zhang, Zhiyuan Yang et al.

Multi-objective optimization problems can be found in many real-world applications, where the objectives often conflict each other and cannot be optimized by a single solution. In the past few decades, numerous methods have been proposed to find Pareto solutions that represent optimal trade-offs among the objectives for a given problem. However, these existing methods could have high computational complexity or may not have good theoretical properties for solving a general differentiable multi-objective optimization problem. In this work, by leveraging the smooth optimization technique, we propose a lightweight and efficient smooth Tchebycheff scalarization approach for gradient-based multi-objective optimization. It has good theoretical properties for finding all Pareto solutions with valid trade-off preferences, while enjoying significantly lower computational complexity compared to other methods. Experimental results on various real-world application problems fully demonstrate the effectiveness of our proposed method.

Fu Luo, Xi Lin, Zhenkun Wang et al.

The end-to-end neural combinatorial optimization (NCO) method shows promising performance in solving complex combinatorial optimization problems without the need for expert design. However, existing methods struggle with large-scale problems, hindering their practical applicability. To overcome this limitation, this work proposes a novel Self-Improved Learning (SIL) method for better scalability of neural combinatorial optimization. Specifically, we develop an efficient self-improved mechanism that enables direct model training on large-scale problem instances without any labeled data. Powered by an innovative local reconstruction approach, this method can iteratively generate better solutions by itself as pseudo-labels to guide efficient model training. In addition, we design a linear complexity attention mechanism for the model to efficiently handle large-scale combinatorial problem instances with low computation overhead. Comprehensive experiments on the Travelling Salesman Problem (TSP) and the Capacitated Vehicle Routing Problem (CVRP) with up to 100K nodes in both uniform and real-world distributions demonstrate the superior scalability of our method.

Yiming Yao, Fei Liu, Ji Cheng et al.

Many real-world optimization scenarios involve expensive evaluation with unknown and heterogeneous costs. Cost-aware Bayesian optimization stands out as a prominent solution in addressing these challenges. To approach the global optimum within a limited budget in a cost-efficient manner, the design of cost-aware acquisition functions (AFs) becomes a crucial step. However, traditional manual design paradigm typically requires extensive domain knowledge and involves a labor-intensive trial-and-error process. This paper introduces EvolCAF, a novel framework that integrates large language models (LLMs) with evolutionary computation (EC) to automatically design cost-aware AFs. Leveraging the crossover and mutation in the algorithmic space, EvolCAF offers a novel design paradigm, significantly reduces the reliance on domain expertise and model training. The designed cost-aware AF maximizes the utilization of available information from historical data, surrogate models and budget details. It introduces novel ideas not previously explored in the existing literature on acquisition function design, allowing for clear interpretations to provide insights into its behavior and decision-making process. In comparison to the well-known EIpu and EI-cool methods designed by human experts, our approach showcases remarkable efficiency and generalization across various tasks, including 12 synthetic problems and 3 real-world hyperparameter tuning test sets.

Fei Liu, Rui Zhang, Zhuoliang Xie et al.

We introduce LLM4AD, a unified Python platform for algorithm design (AD) with large language models (LLMs). LLM4AD is a generic framework with modularized blocks for search methods, algorithm design tasks, and LLM interface. The platform integrates numerous key methods and supports a wide range of algorithm design tasks across various domains including optimization, machine learning, and scientific discovery. We have also designed a unified evaluation sandbox to ensure a secure and robust assessment of algorithms. Additionally, we have compiled a comprehensive suite of support resources, including tutorials, examples, a user manual, online resources, and a dedicated graphical user interface (GUI) to enhance the usage of LLM4AD. We believe this platform will serve as a valuable tool for fostering future development in the merging research direction of LLM-assisted algorithm design.

Song Lai, Haohan Zhao, Rong Feng et al.

Continual post-training (CPT) is a popular and effective technique for adapting foundation models like multimodal large language models to specific and ever-evolving downstream tasks. While existing research has primarily concentrated on methods like data replay, model expansion, or parameter regularization, the fundamental role of the learning paradigm within CPT remains largely unexplored. This paper presents a comparative analysis of two core post-training paradigms: supervised fine-tuning (SFT) and reinforcement fine-tuning (RFT), investigating their respective impacts on knowledge retention during CPT. Our experiments are conducted on a benchmark comprising seven diverse multimodal tasks, utilizing Qwen2.5-VL-7B-Instruct as the base model for continual post-training. The investigation yields two significant findings: (1) When continuously learning on downstream tasks, SFT leads to catastrophic forgetting of previously learned tasks. In contrast, RFT inherently preserves prior knowledge and achieve performance comparable to multi-task training. (2) RFT successfully protects and even enhances the model's general knowledge on standard benchmarks (e.g., MMMU and MMLU-Pro). Conversely, SFT degrades general model capabilities severely. Further analysis reveals that this stability is not primarily due to explicit mechanisms like KL penalty or chain-of-thought reasoning. Instead, we identify an implicit regularization mechanism inherent to RFT as a key contributing factor. Our theoretical analysis suggests that RFT's gradient updates are naturally scaled by the reward variance, acting as a data-dependent regularizer that inherently protects previously acquired knowledge. Finally, we propose a rollout-based instance filtering algorithm to enhance the stability and efficiency of RFT. Our comprehensive study demonstrates the superiority of RFT as a robust paradigm for continual post-training.

Changliang Zhou, Xi Lin, Zhenkun Wang et al.

Constructive neural combinatorial optimization (NCO) has attracted growing research attention due to its ability to solve complex routing problems without relying on handcrafted rules. However, existing NCO methods face significant challenges in generalizing to large-scale problems due to high computational complexity and inefficient capture of structural patterns. To address this issue, we propose a novel learning-based search space reduction method that adaptively selects a small set of promising candidate nodes at each step of the constructive NCO process. Unlike traditional methods that rely on fixed heuristics, our selection model dynamically prioritizes nodes based on learned patterns, significantly reducing the search space while maintaining solution quality. Experimental results demonstrate that our method, trained solely on 100-node instances from uniform distribution, generalizes remarkably well to large-scale Traveling Salesman Problem (TSP) and Capacitated Vehicle Routing Problem (CVRP) instances with up to 1 million nodes from the uniform distribution and over 80K nodes from other distributions.

Ke Li, Fei Liu, Zhengkun Wang et al.

Recent advancements in Neural Combinatorial Optimization (NCO) have shown promise in solving routing problems like the Traveling Salesman Problem (TSP) and Capacitated Vehicle Routing Problem (CVRP) without handcrafted designs. Research in this domain has explored two primary categories of methods: iterative and non-iterative. While non-iterative methods struggle to generate near-optimal solutions directly, iterative methods simplify the task by learning local search steps. However, existing iterative methods are often limited by restricted neighborhood searches, leading to suboptimal results. To address this limitation, we propose a novel approach that extends the search to larger neighborhoods by learning a destroy-and-repair strategy. Specifically, we introduce a Destroy-and-Repair framework based on Hyper-Graphs (DRHG). This framework reduces consecutive intact edges to hyper-edges, allowing the model to pay more attention to the destroyed part and decrease the complexity of encoding all nodes. Experiments demonstrate that DRHG achieves stateof-the-art performance on TSP with up to 10,000 nodes and shows strong generalization to real-world TSPLib and CVRPLib problems.