Kay Chen Tan

Zhichao Lu, Ran Cheng, Yaochu Jin et al.

The ongoing advancements in network architecture design have led to remarkable achievements in deep learning across various challenging computer vision tasks. Meanwhile, the development of neural architecture search (NAS) has provided promising approaches to automating the design of network architectures for lower prediction error. Recently, the emerging application scenarios of deep learning have raised higher demands for network architectures considering multiple design criteria: number of parameters/floating-point operations, and inference latency, among others. From an optimization point of view, the NAS tasks involving multiple design criteria are intrinsically multiobjective optimization problems; hence, it is reasonable to adopt evolutionary multiobjective optimization (EMO) algorithms for tackling them. Nonetheless, there is still a clear gap confining the related research along this pathway: on the one hand, there is a lack of a general problem formulation of NAS tasks from an optimization point of view; on the other hand, there are challenges in conducting benchmark assessments of EMO algorithms on NAS tasks. To bridge the gap: (i) we formulate NAS tasks into general multi-objective optimization problems and analyze the complex characteristics from an optimization point of view; (ii) we present an end-to-end pipeline, dubbed $\texttt{EvoXBench}$, to generate benchmark test problems for EMO algorithms to run efficiently -- without the requirement of GPUs or Pytorch/Tensorflow; (iii) we instantiate two test suites comprehensively covering two datasets, seven search spaces, and three hardware devices, involving up to eight objectives. Based on the above, we validate the proposed test suites using six representative EMO algorithms and provide some empirical analyses. The code of $\texttt{EvoXBench}$ is available from $\href{https://github.com/EMI-Group/EvoXBench}{\rm{here}}$.

Jian Yao, Xiongcai Luo, Ran Cheng et al.

Recent advances in Large Reasoning Models have significantly improved chain-of-thought (CoT) capabilities via reinforcement learning (RL). However, generated reasoning chains frequently suffer from structural redundancy (i.e., \emph{overthinking}), incurring high computational overhead without improving answer correctness. Existing mitigation strategies typically rely on token-uniform length penalties, which provide coarse, segment-agnostic pressure toward shorter outputs and can inadvertently suppress useful reasoning alongside redundancy. To address this, we demonstrate that inefficiency concentrates in high-probability segments with low marginal utility. We derive a theoretical characterization of segment suboptimality under the correctness-length trade-off objective and propose \textsc{SLAT} (Segment-Level Adaptive Trimming), an RL framework that selectively suppresses redundant segments based on this criterion. Empirical results on standard benchmarks indicate that \textsc{SLAT} establishes a superior accuracy-efficiency Pareto frontier, reducing reasoning length by $50\%$ relative to uncompressed baselines while maintaining competitive accuracy. Overall, our results suggest that theoretically grounded, segment-aware trimming is a promising direction for efficient CoT reasoning in large language models.

Xiaoming Xue, Cuie Yang, Liang Feng et al.

Sequential transfer optimization (STO), which aims to improve the optimization performance on a task of interest by exploiting the knowledge captured from several previously-solved optimization tasks stored in a database, has been gaining increasing research attention over the years. However, despite the remarkable advances in algorithm design, the development of a systematic benchmark suite for comprehensive comparisons of STO algorithms received far less attention. Existing test problems are either simply generated by assembling other benchmark functions or extended from specific practical problems with limited scalability. The relationships between the optimal solutions of the source and target tasks in these problems are also often manually configured, limiting their ability to model different similarity relationships presented in real-world problems. Consequently, the good performance achieved by an algorithm on these problems might be biased and hard to be generalized to other problems. In light of the above, in this study, we first introduce four concepts for characterizing STO problems and present an important problem feature, namely similarity distribution, which quantitatively delineates the relationship between the optima of the source and target tasks. Then, we present the general design guidelines of STO problems and a particular STO problem generator with good scalability. Specifically, the similarity distribution of a problem can be easily customized, enabling a continuous spectrum of representation of the diverse similarity relationships of real-world problems. Lastly, a benchmark suite with 12 STO problems featured by a variety of customized similarity relationships is developed using the proposed generator. The source code of the problem generator is available at https://github.com/XmingHsueh/STOP-G.

Songbai Liu, Qiuzhen Lin, Jianqiang Li et al.

Recent decades have witnessed great advancements in multiobjective evolutionary algorithms (MOEAs) for multiobjective optimization problems (MOPs). However, these progressively improved MOEAs have not necessarily been equipped with scalable and learnable problem-solving strategies for new and grand challenges brought by the scaling-up MOPs with continuously increasing complexity from diverse aspects, mainly including expensive cost of function evaluations, many objectives, large-scale search space, time-varying environments, and multi-task. Under different scenarios, divergent thinking is required in designing new powerful MOEAs for solving them effectively. In this context, research studies on learnable MOEAs with machine learning techniques have received extensive attention in the field of evolutionary computation. This paper begins with a general taxonomy of scaling-up MOPs and learnable MOEAs, followed by an analysis of the challenges that these MOPs pose to traditional MOEAs. Then, we synthetically overview recent advances of learnable MOEAs in solving various scaling-up MOPs, focusing primarily on four attractive directions (i.e., learnable evolutionary discriminators for environmental selection, learnable evolutionary generators for reproduction, learnable evolutionary evaluators for function evaluations, and learnable evolutionary transfer modules for sharing or reusing optimization experience). The insight of learnable MOEAs is offered to readers as a reference to the general track of the efforts in this field.

Junjia Liu, Zhihao Li, Wanyu Lin et al.

Soft object manipulation tasks in domestic scenes pose a significant challenge for existing robotic skill learning techniques due to their complex dynamics and variable shape characteristics. Since learning new manipulation skills from human demonstration is an effective way for robot applications, developing prior knowledge of the representation and dynamics of soft objects is necessary. In this regard, we propose a pre-trained soft object manipulation skill learning model, namely SoftGPT, that is trained using large amounts of exploration data, consisting of a three-dimensional heterogeneous graph representation and a GPT-based dynamics model. For each downstream task, a goal-oriented policy agent is trained to predict the subsequent actions, and SoftGPT generates the consequences of these actions. Integrating these two approaches establishes a thinking process in the robot's mind that provides rollout for facilitating policy learning. Our results demonstrate that leveraging prior knowledge through this thinking process can efficiently learn various soft object manipulation skills, with the potential for direct learning from human demonstrations.

Xiang Hao, Jibin Wu, Jianwei Yu et al.

Humans can easily isolate a single speaker from a complex acoustic environment, a capability referred to as the "Cocktail Party Effect." However, replicating this ability has been a significant challenge in the field of target speaker extraction (TSE). Traditional TSE approaches predominantly rely on voiceprints, which raise privacy concerns and face issues related to the quality and availability of enrollment samples, as well as intra-speaker variability. To address these issues, this work introduces a novel text-guided TSE paradigm named LLM-TSE. In this paradigm, a state-of-the-art large language model, LLaMA 2, processes typed text input from users to extract semantic cues. We demonstrate that textual descriptions alone can effectively serve as cues for extraction, thus addressing privacy concerns and reducing dependency on voiceprints. Furthermore, our approach offers flexibility by allowing the user to specify the extraction or suppression of a speaker and enhances robustness against intra-speaker variability by incorporating context-dependent textual information. Experimental results show competitive performance with text-based cues alone and demonstrate the effectiveness of using text as a task selector. Additionally, they achieve a new state-of-the-art when combining text-based cues with pre-registered cues. This work represents the first integration of LLMs with TSE, potentially establishing a new benchmark in solving the cocktail party problem and expanding the scope of TSE applications by providing a versatile, privacy-conscious solution.

Haokai Hong, Min Jiang, Qiuzhen Lin et al.

We define very large-scale multiobjective optimization problems as optimizing multiple objectives (VLSMOPs) with more than 100,000 decision variables. These problems hold substantial significance, given the ubiquity of real-world scenarios necessitating the optimization of hundreds of thousands, if not millions, of variables. However, the larger dimension in VLSMOPs intensifies the curse of dimensionality and poses significant challenges for existing large-scale evolutionary multiobjective algorithms, rendering them more difficult to solve within the constraints of practical computing resources. To overcome this issue, we propose a novel approach called the very large-scale multiobjective optimization framework (VMOF). The method efficiently samples general yet suitable evolutionary directions in the very large-scale space and subsequently fine-tunes these directions to locate the Pareto-optimal solutions. To sample the most suitable evolutionary directions for different solutions, Thompson sampling is adopted for its effectiveness in recommending from a very large number of items within limited historical evaluations. Furthermore, a technique is designed for fine-tuning directions specific to tracking Pareto-optimal solutions. To understand the designed framework, we present our analysis of the framework and then evaluate VMOF using widely recognized benchmarks and real-world problems spanning dimensions from 100 to 1,000,000. Experimental results demonstrate that our method exhibits superior performance not only on LSMOPs but also on VLSMOPs when compared to existing algorithms.

Xun Zhou, Xingyu Wu, Liang Feng et al.

Transferable neural architecture search (TNAS) has been introduced to design efficient neural architectures for multiple tasks, to enhance the practical applicability of NAS in real-world scenarios. In TNAS, architectural knowledge accumulated in previous search processes is reused to warm up the architecture search for new tasks. However, existing TNAS methods still search in an extensive search space, necessitating the evaluation of numerous architectures. To overcome this challenge, this work proposes a novel transfer paradigm, i.e., design principle transfer. In this work, the linguistic description of various structural components' effects on architectural performance is termed design principles. They are learned from established architectures and then can be reused to reduce the search space by discarding unpromising architectures. Searching in the refined search space can boost both the search performance and efficiency for new NAS tasks. To this end, a large language model (LLM)-assisted design principle transfer (LAPT) framework is devised. In LAPT, LLM is applied to automatically reason the design principles from a set of given architectures, and then a principle adaptation method is applied to refine these principles progressively based on the new search results. Experimental results show that LAPT can beat the state-of-the-art TNAS methods on most tasks and achieve comparable performance on others.

Yuwei Ou, Xiangning Xie, Shangce Gao et al.

Deep neural networks (DNNs) are found to be vulnerable to adversarial attacks, and various methods have been proposed for the defense. Among these methods, adversarial training has been drawing increasing attention because of its simplicity and effectiveness. However, the performance of the adversarial training is greatly limited by the architectures of target DNNs, which often makes the resulting DNNs with poor accuracy and unsatisfactory robustness. To address this problem, we propose DSARA to automatically search for the neural architectures that are accurate and robust after adversarial training. In particular, we design a novel cell-based search space specially for adversarial training, which improves the accuracy and the robustness upper bound of the searched architectures by carefully designing the placement of the cells and the proportional relationship of the filter numbers. Then we propose a two-stage search strategy to search for both accurate and robust neural architectures. At the first stage, the architecture parameters are optimized to minimize the adversarial loss, which makes full use of the effectiveness of the adversarial training in enhancing the robustness. At the second stage, the architecture parameters are optimized to minimize both the natural loss and the adversarial loss utilizing the proposed multi-objective adversarial training method, so that the searched neural architectures are both accurate and robust. We evaluate the proposed algorithm under natural data and various adversarial attacks, which reveals the superiority of the proposed method in terms of both accurate and robust architectures. We also conclude that accurate and robust neural architectures tend to deploy very different structures near the input and the output, which has great practical significance on both hand-crafting and automatically designing of accurate and robust neural architectures.

Xingyu Wu, Yan Zhong, Jibin Wu et al.

Algorithm selection, a critical process of automated machine learning, aims to identify the most suitable algorithm for solving a specific problem prior to execution. Mainstream algorithm selection techniques heavily rely on problem features, while the role of algorithm features remains largely unexplored. Due to the intrinsic complexity of algorithms, effective methods for universally extracting algorithm information are lacking. This paper takes a significant step towards bridging this gap by introducing Large Language Models (LLMs) into algorithm selection for the first time. By comprehending the code text, LLM not only captures the structural and semantic aspects of the algorithm, but also demonstrates contextual awareness and library function understanding. The high-dimensional algorithm representation extracted by LLM, after undergoing a feature selection module, is combined with the problem representation and passed to the similarity calculation module. The selected algorithm is determined by the matching degree between a given problem and different algorithms. Extensive experiments validate the performance superiority of the proposed model and the efficacy of each key module. Furthermore, we present a theoretical upper bound on model complexity, showcasing the influence of algorithm representation and feature selection modules. This provides valuable theoretical guidance for the practical implementation of our method.

Yu Zhou, Xingyu Wu, Jibin Wu et al.

Model merging is a technique that combines multiple large pretrained models into a single model with enhanced performance and broader task adaptability. It has gained popularity in large pretrained model development due to its ability to bypass the need for original training data and further training processes. However, most existing model merging approaches focus solely on exploring the parameter space, merging models with identical architectures. Merging within the architecture space, despite its potential, remains in its early stages due to the vast search space and the challenges of layer compatibility. This paper marks a significant advance toward more flexible and comprehensive model merging techniques by modeling the architecture-space merging process as a reinforcement learning task. We train policy and value networks using offline sampling of weight vectors, which are then employed for the online optimization of merging strategies. Moreover, a multi-objective optimization paradigm is introduced to accommodate users' diverse task preferences, learning the Pareto front of optimal models to offer customized merging suggestions. Experimental results across multiple tasks, including text translation, mathematical reasoning, and code generation, validate the effectiveness and superiority of the proposed framework in model merging. The code will be made publicly available after the review process.

Fan Xu, Zhi-an Huang, Haohuai He et al.

Accurate prediction of antibody-antigen binding affinity is fundamental to therapeutic design, yet remains constrained by severe label sparsity and the complexity of antigenic variations. In this paper, we propose AbLWR (Antibody-antigen binding affinity List-Wise Ranking), a novel framework that reformulates the conventional affinity regression task as a listwise ranking problem. To mitigate label sparsity, AbLWR incorporates a PU (Positive-Unlabeled) learning mechanism leveraging a dual-level contrastive objective and meta-optimized label refinement to learn robust representations. Furthermore, we address antigenic variation by employing a homologous antigen sampling strategy where Multi-Head Self-Attention (MHSA) explicitly models inter-sample relationships within training lists to capture subtle affinity nuances. Extensive experiments demonstrate that AbLWR significantly outperforms state-of-the-art baselines, improving the Precision@1 (P@1) by over 10$\%$ in randomized cross-validation experiments. Notably, case studies on Influenza and IL-33 validate its practical utility, demonstrating robust ranking consistency in distinguishing subtle viral mutations and efficiently prioritizing top-tier candidates for wet-lab screening.

Xuebin Lyu, Yuxiao Huang, XueFeng Chen et al.

Evolutionary multi-task optimization (EMTO) is an advanced optimization paradigm that improves search efficiency by enabling knowledge transfer across multiple tasks solved in parallel. Accordingly, a broad range of knowledge transfer methods (KTMs) have been developed as integral components of EMTO algorithms, most of which are tailored to specific problem settings. However, the design of effective KTMs typically relies on substantial domain expertise and careful manual customization, as different EMTO scenarios require distinct transfer strategies to achieve performance gains. Meanwhile, recent advances in large language models (LLMs) have demonstrated strong capabilities in autonomous programming and algorithm synthesis, opening up new possibilities for automating the design of optimization solvers. Motivated by this, in this paper, we propose a Self-guided Knowledge Transfer Design (SKTD) framework that leverages LLMs to autonomously generate knowledge transfer methods (KTMs) as algorithmic components within EMTO. By enabling data-driven and self-adaptive construction of transfer strategies, SKTD facilitates effective knowledge reuse across heterogeneous tasks and diverse EMTO scenarios. To the best of our knowledge, this work represents the first attempt to automate the generation of KTMs for EMTO. Extensive experiments on well-established EMTO benchmarks with varying degrees of task similarity demonstrate that the proposed SKTD consistently achieves superior or highly competitive performance compared with both the state-of-the-art program search approach and manually designed EMTO methods, in terms of optimization effectiveness and cross-scenario generalization.

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

In this survey, we introduce Meta-Black-Box-Optimization~(MetaBBO) as an emerging avenue within the Evolutionary Computation~(EC) community, which incorporates Meta-learning approaches to assist automated algorithm design. Despite the success of MetaBBO, the current literature provides insufficient summaries of its key aspects and lacks practical guidance for implementation. To bridge this gap, we offer a comprehensive review of recent advances in MetaBBO, providing an in-depth examination of its key developments. We begin with a unified definition of the MetaBBO paradigm, followed by a systematic taxonomy of various algorithm design tasks, including algorithm selection, algorithm configuration, solution manipulation, and algorithm generation. Further, we conceptually summarize different learning methodologies behind current MetaBBO works, including reinforcement learning, supervised learning, neuroevolution, and in-context learning with Large Language Models. A comprehensive evaluation of the latest representative MetaBBO methods is then carried out, alongside an experimental analysis of their optimization performance, computational efficiency, and generalization ability. Based on the evaluation results, we meticulously identify a set of core designs that enhance the generalization and learning effectiveness of MetaBBO. Finally, we outline the vision for the field by providing insight into the latest trends and potential future directions. Relevant literature will be continuously collected and updated at https://github.com/MetaEvo/Awesome-MetaBBO.

Chenxiang Ma, Jibin Wu, Chenyang Si et al.

Deep neural networks are typically trained using global error signals that backpropagate (BP) end-to-end, which is not only biologically implausible but also suffers from the update locking problem and requires huge memory consumption. Local learning, which updates each layer independently with a gradient-isolated auxiliary network, offers a promising alternative to address the above problems. However, existing local learning methods are confronted with a large accuracy gap with the BP counterpart, particularly for large-scale networks. This is due to the weak coupling between local layers and their subsequent network layers, as there is no gradient communication across layers. To tackle this issue, we put forward an augmented local learning method, dubbed AugLocal. AugLocal constructs each hidden layer's auxiliary network by uniformly selecting a small subset of layers from its subsequent network layers to enhance their synergy. We also propose to linearly reduce the depth of auxiliary networks as the hidden layer goes deeper, ensuring sufficient network capacity while reducing the computational cost of auxiliary networks. Our extensive experiments on four image classification datasets (i.e., CIFAR-10, SVHN, STL-10, and ImageNet) demonstrate that AugLocal can effectively scale up to tens of local layers with a comparable accuracy to BP-trained networks while reducing GPU memory usage by around 40%. The proposed AugLocal method, therefore, opens up a myriad of opportunities for training high-performance deep neural networks on resource-constrained platforms.Code is available at https://github.com/ChenxiangMA/AugLocal.

Wenlong Hou, Sheng Bi, Guangqian Yang et al.

Alzheimer's disease (AD) is a growing global health challenge as populations age, and timely, accurate diagnosis is essential to reduce individual and societal burden. However, real-world AD assessment is hampered by incomplete, heterogeneous multimodal data and variability across sites and patient demographics. Although large language models (LLMs) have shown promise in biomedicine, their use in AD has largely been confined to answering narrow, disease-specific questions rather than generating comprehensive diagnostic reports that support clinical decision-making. Here we expand LLM capabilities for clinical decision support by introducing AD-CARE, a modality-agnostic agent that performs guideline-grounded diagnostic assessment from incomplete, heterogeneous inputs without imputing missing modalities. By dynamically orchestrating specialized diagnostic tools and embedding clinical guidelines into LLM-driven reasoning, AD-CARE generates transparent, report-style outputs aligned with real-world clinical workflows. Across six cohorts comprising 10,303 cases, AD-CARE achieved 84.9% diagnostic accuracy, delivering 4.2%-13.7% relative improvements over baseline methods. Despite cohort-level differences, dataset-specific accuracies remain robust (80.4%-98.8%), and the agent consistently outperforms all baselines. AD-CARE reduced performance disparities across racial and age subgroups, decreasing the average dispersion of four metrics by 21%-68% and 28%-51%, respectively. In a controlled reader study, the agent improved neurologist and radiologist accuracy by 6%-11% and more than halved decision time. The framework yielded 2.29%-10.66% absolute gains over eight backbone LLMs and converges their performance. These results show that AD-CARE is a scalable, practically deployable framework that can be integrated into routine clinical workflows for multimodal decision support in AD.

Haokai Hong, Wanyu Lin, Kay Chen Tan

This paper proposes a new 3D molecule generation framework, called GOAT, for fast and effective 3D molecule generation based on the flow-matching optimal transport objective. Specifically, we formulate a geometric transport formula for measuring the cost of mapping multi-modal features (e.g., continuous atom coordinates and categorical atom types) between a base distribution and a target data distribution. Our formula is solved within a joint, equivariant, and smooth representation space. This is achieved by transforming the multi-modal features into a continuous latent space with equivariant networks. In addition, we find that identifying optimal distributional coupling is necessary for fast and effective transport between any two distributions. We further propose a mechanism for estimating and purifying optimal coupling to train the flow model with optimal transport. By doing so, GOAT can turn arbitrary distribution couplings into new deterministic couplings, leading to an estimated optimal transport plan for fast 3D molecule generation. The purification filters out the subpar molecules to ensure the ultimate generation quality. We theoretically and empirically prove that the proposed optimal coupling estimation and purification yield transport plan with non-increasing cost. Finally, extensive experiments show that GOAT enjoys the efficiency of solving geometric optimal transport, leading to a double speedup compared to the sub-optimal method while achieving the best generation quality regarding validity, uniqueness, and novelty. The code is available at https://github.com/WanyuGroup/ICLR2025-GOAT.

Yisong Zhang, Ran Cheng, Guoxing Yi et al.

Large Language Models (LLMs), with their strong understanding and reasoning capabilities, are increasingly being explored for tackling optimization problems, especially in synergy with evolutionary computation. Despite rapid progress, however, the field still lacks a unified synthesis and a systematic taxonomy. This survey addresses this gap by providing a comprehensive review of recent developments and organizing them within a structured framework. We classify existing research into two main stages: LLMs for optimization modeling and LLMs for optimization solving. The latter is further divided into three paradigms according to the role of LLMs in the optimization workflow: LLMs as stand-alone optimizers, low-level LLMs embedded within optimization algorithms, and high-level LLMs for algorithm selection and generation. For each category, we analyze representative methods, distill technical challenges, and examine their interplay with traditional approaches. We also review interdisciplinary applications spanning the natural sciences, engineering, and machine learning. By contrasting LLM-driven and conventional methods, we highlight key limitations and research gaps, and point toward future directions for developing self-evolving agentic ecosystems for optimization. An up-to-date collection of related literature is maintained at https://github.com/ishmael233/LLM4OPT.

Haiyun Qiu, Xingyu Wu, Liang Feng et al.

Model merging constructs versatile models by integrating task-specific models without requiring labeled data or expensive joint retraining. Although recent methods improve adaptability to heterogeneous tasks by generating customized merged models for each instance, they face two critical limitations. First, the instance-specific merged models lack reusability, restricting the exploitation of high-quality merging configurations and efficient batch inference. Second, these methods treat each task-specific model as a monolithic whole, overlooking the diverse mergeability of homologous components such as attention and multilayer perceptron layers, and the differing merging sensitivities across components. To address these limitations, we propose MERGE (\underline{M}odular \underline{E}xpert \underline{R}ecombination for fine-\underline{G}rained m\underline{E}rging), a method that enables component-wise model merging and input-aware, on-demand module recombination at inference. MERGE formulates component-wise merging as a bi-objective optimization problem that balances cross-task performance and storage efficiency, and develops a surrogate-assisted evolutionary algorithm to efficiently identify Pareto-optimal merging configurations. These high-quality configurations underpin a reusable modular expert library, from which a lightweight routing network dynamically activates and recombines modular experts to assemble input-specific models and enable efficient inference under storage constraints. Extensive experiments across various model scales, task types, and fine-tuning strategies demonstrate that MERGE consistently outperforms strong baselines and generalizes effectively.

Beichen Huang, Ran Cheng, Kay Chen Tan

We introduce EvoGit, a decentralized multi-agent framework for collaborative software development driven by autonomous code evolution. EvoGit deploys a population of independent coding agents, each proposing edits to a shared codebase without centralized coordination, explicit message passing, or shared memory. Instead, all coordination emerges through a Git-based phylogenetic graph that tracks the full version lineage and enables agents to asynchronously read from and write to the evolving code repository. This graph-based structure supports fine-grained branching, implicit concurrency, and scalable agent interaction while preserving a consistent historical record. Human involvement is minimal but strategic: users define high-level goals, periodically review the graph, and provide lightweight feedback to promote promising directions or prune unproductive ones. Experiments demonstrate EvoGit's ability to autonomously produce functional and modular software artifacts across two real-world tasks: (1) building a web application from scratch using modern frameworks, and (2) constructing a meta-level system that evolves its own language-model-guided solver for the bin-packing optimization problem. Our results underscore EvoGit's potential to establish a new paradigm for decentralized, automated, and continual software development. EvoGit is open-sourced at https://github.com/BillHuang2001/evogit.

Yu-An Huang, Yao Hu, Yue-Chao Li et al.

Functional MRI (fMRI) and single-cell transcriptomics are pivotal in Alzheimer's disease (AD) research, each providing unique insights into neural function and molecular mechanisms. However, integrating these complementary modalities remains largely unexplored. Here, we introduce scBIT, a novel method for enhancing AD prediction by combining fMRI with single-nucleus RNA (snRNA). scBIT leverages snRNA as an auxiliary modality, significantly improving fMRI-based prediction models and providing comprehensive interpretability. It employs a sampling strategy to segment snRNA data into cell-type-specific gene networks and utilizes a self-explainable graph neural network to extract critical subgraphs. Additionally, we use demographic and genetic similarities to pair snRNA and fMRI data across individuals, enabling robust cross-modal learning. Extensive experiments validate scBIT's effectiveness in revealing intricate brain region-gene associations and enhancing diagnostic prediction accuracy. By advancing brain imaging transcriptomics to the single-cell level, scBIT sheds new light on biomarker discovery in AD research. Experimental results show that incorporating snRNA data into the scBIT model significantly boosts accuracy, improving binary classification by 3.39% and five-class classification by 26.59%. The codes were implemented in Python and have been released on GitHub (https://github.com/77YQ77/scBIT) and Zenodo (https://zenodo.org/records/11599030) with detailed instructions.

Xingyu Wu, Sheng-hao Wu, Jibin Wu et al.

Large language models (LLMs) have not only revolutionized natural language processing but also extended their prowess to various domains, marking a significant stride towards artificial general intelligence. The interplay between LLMs and evolutionary algorithms (EAs), despite differing in objectives and methodologies, share a common pursuit of applicability in complex problems. Meanwhile, EA can provide an optimization framework for LLM's further enhancement under black-box settings, empowering LLM with flexible global search capacities. On the other hand, the abundant domain knowledge inherent in LLMs could enable EA to conduct more intelligent searches. Furthermore, the text processing and generative capabilities of LLMs would aid in deploying EAs across a wide range of tasks. Based on these complementary advantages, this paper provides a thorough review and a forward-looking roadmap, categorizing the reciprocal inspiration into two main avenues: LLM-enhanced EA and EA-enhanced LLM. Some integrated synergy methods are further introduced to exemplify the complementarity between LLMs and EAs in diverse scenarios, including code generation, software engineering, neural architecture search, and various generation tasks. As the first comprehensive review focused on the EA research in the era of LLMs, this paper provides a foundational stepping stone for understanding the collaborative potential of LLMs and EAs. The identified challenges and future directions offer guidance for researchers and practitioners to unlock the full potential of this innovative collaboration in propelling advancements in optimization and artificial intelligence. We have created a GitHub repository to index the relevant papers: https://github.com/wuxingyu-ai/LLM4EC.

Songbai Liu, Qiuzhen Lin, Kay Chen Tan et al.

Evolutionary transfer multiobjective optimization (ETMO) has been becoming a hot research topic in the field of evolutionary computation, which is based on the fact that knowledge learning and transfer across the related optimization exercises can improve the efficiency of others. Besides, the potential for transfer optimization is deemed invaluable from the standpoint of human-like problem-solving capabilities where knowledge gather and reuse are instinctive. To promote the research on ETMO, benchmark problems are of great importance to ETMO algorithm analysis, which helps designers or practitioners to understand the merit and demerit better of ETMO algorithms. Therefore, a total number of 40 benchmark functions are proposed in this report, covering diverse types and properties in the case of knowledge transfer, such as various formulation models, various PS geometries and PF shapes, large-scale of variables, dynamically changed environment, and so on. All the benchmark functions have been implemented in JAVA code, which can be downloaded on the following website: https://github.com/songbai-liu/etmo.

Yuxiao Huang, Wenjie Zhang, Liang Feng et al.

Recently, large language models (LLMs) have notably positioned them as capable tools for addressing complex optimization challenges. Despite this recognition, a predominant limitation of existing LLM-based optimization methods is their struggle to capture the relationships among decision variables when relying exclusively on numerical text prompts, especially in high-dimensional problems. Keeping this in mind, we first propose to enhance the optimization performance using multimodal LLM capable of processing both textual and visual prompts for deeper insights of the processed optimization problem. This integration allows for a more comprehensive understanding of optimization problems, akin to human cognitive processes. We have developed a multimodal LLM-based optimization framework that simulates human problem-solving workflows, thereby offering a more nuanced and effective analysis. The efficacy of this method is evaluated through extensive empirical studies focused on a well-known combinatorial optimization problem, i.e., capacitated vehicle routing problem. The results are compared against those obtained from the LLM-based optimization algorithms that rely solely on textual prompts, demonstrating the significant advantages of our multimodal approach.

Jian Yao, Ran Cheng, Xingyu Wu et al.

The reasoning capabilities of large language models (LLMs) have advanced rapidly, particularly following the release of DeepSeek R1, which has inspired a surge of research into data quality and reinforcement learning (RL) algorithms. Despite the pivotal role diversity plays in RL, its influence on LLM reasoning remains largely underexplored. To bridge this gap, this work presents a systematic investigation into the impact of diversity in RL-based training for LLM reasoning, and proposes a novel diversity-aware policy optimization method. Across evaluations on 12 LLMs, we observe a strong positive correlation between the solution diversity and Potential at k (a novel metric quantifying an LLM's reasoning potential) in high-performing models. This finding motivates our method to explicitly promote diversity during RL training. Specifically, we design a token-level diversity and reformulate it into a practical objective, then we selectively apply it to positive samples. Integrated into the R1-zero training framework, our method achieves a 3.5 percent average improvement across four mathematical reasoning benchmarks, while generating more diverse and robust solutions.

Yu Zhou, Xingyu Wu, Beicheng Huang et al.

The ability to understand causality significantly impacts the competence of large language models (LLMs) in output explanation and counterfactual reasoning, as causality reveals the underlying data distribution. However, the lack of a comprehensive benchmark currently limits the evaluation of LLMs' causal learning capabilities. To fill this gap, this paper develops CausalBench based on data from the causal research community, enabling comparative evaluations of LLMs against traditional causal learning algorithms. To provide a comprehensive investigation, we offer three tasks of varying difficulties, including correlation, causal skeleton, and causality identification. Evaluations of 19 leading LLMs reveal that, while closed-source LLMs show potential for simple causal relationships, they significantly lag behind traditional algorithms on larger-scale networks ($>50$ nodes). Specifically, LLMs struggle with collider structures but excel at chain structures, especially at long-chain causality analogous to Chains-of-Thought techniques. This supports the current prompt approaches while suggesting directions to enhance LLMs' causal reasoning capability. Furthermore, CausalBench incorporates background knowledge and training data into prompts to thoroughly unlock LLMs' text-comprehension ability during evaluation, whose findings indicate that, LLM understand causality through semantic associations with distinct entities, rather than directly from contextual information or numerical distributions.

Haiyun Qiu, Xingyu Wu, Kay Chen Tan

Continual Model Merging (CMM) sequentially integrates task-specific models into a unified architecture without intensive retraining. However, existing CMM methods are hindered by a fundamental saturation-redundancy dilemma: backbone-centric approaches face parameter saturation and representation interference within fixed capacities, whereas Mixture-of-Experts (MoE) variants resort to indiscriminate expansion, incurring expert redundancy and a routing bottleneck reliant on additional data-driven optimization. To resolve these challenges, we propose MADE-IT (Manifold-Aware Dynamic Expert Evolution and Implicit rouTing), an adaptive CMM method that orchestrates expert management and activation by grounding intrinsic expert representations in manifold geometry. We introduce a projection-based subspace affinity metric coupled with a distribution-aware adaptive threshold mechanism to guide autonomous expert evolution, harmonizing diversity with architectural parsimony. Furthermore, to bypass parameterized gating networks, we design a data-free and training-free implicit routing mechanism that activates experts via feature-subspace alignment. Extensive experiments demonstrate that MADE-IT consistently outperforms strong baselines in accuracy and robustness across long-horizon and shuffled task sequences, while significantly pruning redundant experts, particularly within generic modules and early layers.

Zhenzhong Wang, Qingyuan Zeng, Wanyu Lin et al.

While graph neural networks (GNNs) have become the de-facto standard for graph-based node classification, they impose a strong assumption on the availability of sufficient labeled samples. This assumption restricts the classification performance of prevailing GNNs on many real-world applications suffering from low-data regimes. Specifically, features extracted from scarce labeled nodes could not provide sufficient supervision for the unlabeled samples, leading to severe over-fitting. In this work, we point out that leveraging subgraphs to capture long-range dependencies can augment the representation of a node with homophily properties, thus alleviating the low-data regime. However, prior works leveraging subgraphs fail to capture the long-range dependencies among nodes. To this end, we present a novel self-supervised learning framework, called multi-view subgraph neural networks (Muse), for handling long-range dependencies. In particular, we propose an information theory-based identification mechanism to identify two types of subgraphs from the views of input space and latent space, respectively. The former is to capture the local structure of the graph, while the latter captures the long-range dependencies among nodes. By fusing these two views of subgraphs, the learned representations can preserve the topological properties of the graph at large, including the local structure and long-range dependencies, thus maximizing their expressiveness for downstream node classification tasks. Experimental results show that Muse outperforms the alternative methods on node classification tasks with limited labeled data.

Xingyu Wu, Kui Yu, Jibin Wu et al.

This paper critically re-evaluates LLMs' role in causal discovery and argues against their direct involvement in determining causal relationships. We demonstrate that LLMs' autoregressive, correlation-driven modeling inherently lacks the theoretical grounding for causal reasoning and introduces unreliability when used as priors in causal discovery algorithms. Through empirical studies, we expose the limitations of existing LLM-based methods and reveal that deliberate prompt engineering (e.g., injecting ground-truth knowledge) could overstate their performance, helping to explain the consistently favorable results reported in much of the current literature. Based on these findings, we strictly confined LLMs' role to a non-decisional auxiliary capacity: LLMs should not participate in determining the existence or directionality of causal relationships, but can assist the search process for causal graphs (e.g., LLM-based heuristic search). Experiments across various settings confirm that, by strictly isolating LLMs from causal decision-making, LLM-guided heuristic search can accelerate the convergence and outperform both traditional and LLM-based methods in causal structure learning. We conclude with a call for the community to shift focus from naively applying LLMs to developing specialized models and training method that respect the core principles of causal discovery.

Haokai Hong, Wanyu Lin, Kay Chen Tan

Can we train a molecule generator that can generate 3D molecules from a new domain, circumventing the need to collect data? This problem can be cast as the problem of domain adaptive molecule generation. This work presents a novel and principled diffusion-based approach, called GADM, that allows shifting a generative model to desired new domains without the need to collect even a single molecule. As the domain shift is typically caused by the structure variations of molecules, e.g., scaffold variations, we leverage a designated equivariant masked autoencoder (MAE) along with various masking strategies to capture the structural-grained representations of the in-domain varieties. In particular, with an asymmetric encoder-decoder module, the MAE can generalize to unseen structure variations from the target domains. These structure variations are encoded with an equivariant encoder and treated as domain supervisors to control denoising. We show that, with these encoded structural-grained domain supervisors, GADM can generate effective molecules within the desired new domains. We conduct extensive experiments across various domain adaptation tasks over benchmarking datasets. We show that our approach can improve up to 65.6% in terms of success rate defined based on molecular validity, uniqueness, and novelty compared to alternative baselines.

Jian Yao, Ran Cheng, Kay Chen Tan

Recent advances in reinforcement learning (RL) have led to substantial improvements in the mathematical reasoning abilities of LLMs, as measured by standard benchmarks. Yet these gains often persist even when models are trained with flawed signals, such as random or inverted rewards. This raises a fundamental question: do such improvements reflect genuine reasoning, or are they merely artifacts of overfitting to benchmark-specific patterns? To answer this question, we adopt an evaluation-centric perspective and highlight two critical shortcomings in existing protocols. First, benchmark contamination arises because test problems are publicly available, thereby increasing the risk of data leakage. Second, evaluation fragility results from reliance on single-instance assessments, which are sensitive to stochastic outputs and fail to capture reasoning consistency. These limitations suggest the need for a new evaluation paradigm that can probe reasoning ability beyond memorization and one-off success. As response, we propose VAR-MATH, a symbolic evaluation framework that converts fixed numerical problems into parameterized templates and requires models to solve multiple instantiations of each. This design enforces consistency across structurally equivalent variants, mitigates contamination, and enhances robustness through bootstrapped metrics. We apply VAR-MATH to transform three popular benchmarks, AMC23, AIME24, and AIME25, into their symbolic counterparts, VAR-AMC23, VAR-AIME24, and VAR-AIME25. Experimental results show substantial performance drops for RL-trained models on these variabilized benchmarks, especially for smaller models, with average declines of 47.9\% on AMC23, 58.8\% on AIME24, and 72.9\% on AIME25. These findings indicate that some existing RL methods rely on superficial heuristics and fail to generalize beyond specific numerical forms.

Jiajun Zhan, Zeyuan Ma, Yue-Jiao Gong et al.

Evolutionary multitasking (EMT) algorithms typically require tailored designs for knowledge transfer, in order to assure convergence and optimality in multitask optimization. In this paper, we explore designing a systematic and generalizable knowledge transfer policy through Reinforcement Learning. We first identify three major challenges: determining the task to transfer (where), the knowledge to be transferred (what) and the mechanism for the transfer (how). To address these challenges, we formulate a multi-role RL system where three (groups of) policy networks act as specialized agents: a task routing agent incorporates an attention-based similarity recognition module to determine source-target transfer pairs via attention scores; a knowledge control agent determines the proportion of elite solutions to transfer; and a group of strategy adaptation agents control transfer strength by dynamically controlling hyper-parameters in the underlying EMT framework. Through pre-training all network modules end-to-end over an augmented multitask problem distribution, a generalizable meta-policy is obtained. Comprehensive validation experiments show state-of-the-art performance of our method against representative baselines. Further in-depth analysis not only reveals the rationale behind our proposal but also provide insightful interpretations on what the system have learned.

Chenxiang Ma, Xinyi Chen, Yujie Wu et al.

Spiking neural networks (SNNs), recognized as an energy-efficient alternative to traditional artificial neural networks (ANNs), have advanced rapidly through the scaling of models and datasets. However, such scaling incurs considerable training overhead, posing challenges for researchers with limited computational resources and hindering the sustained development of SNNs. Data pruning is a promising strategy for accelerating training by retaining the most informative examples and discarding redundant ones, but it remains largely unexplored in SNNs. Directly applying ANN-based data pruning methods to SNNs fails to capture the intrinsic importance of examples and suffers from high gradient variance. To address these challenges, we propose a novel spike-aware data pruning (SADP) method. SADP reduces gradient variance by determining each example's selection probability to be proportional to its gradient norm, while avoiding the high cost of direct gradient computation through an efficient upper bound, termed spike-aware importance score. This score accounts for the influence of all-or-nothing spikes on the gradient norm and can be computed with negligible overhead. Extensive experiments across diverse datasets and architectures demonstrate that SADP consistently outperforms data pruning baselines and achieves training speedups close to the theoretical maxima at different pruning ratios. Notably, SADP reduces training time by 35% on ImageNet while maintaining accuracy comparable to that of full-data training. This work, therefore, establishes a data-centric paradigm for efficient SNN training and paves the way for scaling SNNs to larger models and datasets. The source code will be released publicly after the review process.

Qingyuan Zeng, Shu Jiang, Jiajing Lin et al.

With the rise of 3D Gaussian Splatting (3DGS), a variety of digital watermarking techniques, embedding either 1D bitstreams or 2D images, are used for copyright protection. However, the robustness of these watermarking techniques against potential attacks remains underexplored. This paper introduces the first universal black-box attack framework, the Group-based Multi-objective Evolutionary Attack (GMEA), designed to challenge these watermarking systems. We formulate the attack as a large-scale multi-objective optimization problem, balancing watermark removal with visual quality. In a black-box setting, we introduce an indirect objective function that blinds the watermark detector by minimizing the standard deviation of features extracted by a convolutional network, thus rendering the feature maps uninformative. To manage the vast search space of 3DGS models, we employ a group-based optimization strategy to partition the model into multiple, independent sub-optimization problems. Experiments demonstrate that our framework effectively removes both 1D and 2D watermarks from mainstream 3DGS watermarking methods while maintaining high visual fidelity. This work reveals critical vulnerabilities in existing 3DGS copyright protection schemes and calls for the development of more robust watermarking systems.

Zongxian Yang, Jiayu Qian, Zhi-An Huang et al.

Large language models (LLMs) face significant challenges in specialized biomedical tasks due to the inherent complexity of medical reasoning and the sensitive nature of clinical data. Existing LLMs often struggle with intricate medical terminology and the need for accurate clinical insights, leading to performance reduction when quantized for resource-constrained deployment. To address these issues, we propose Quantized Medical Tree of Thought (QM-ToT), a path-based reasoning framework. QM-ToT leverages a Tree of Thought (ToT) reasoning approach to decompose complex medical problems into manageable subtasks, coupled with evaluator assessment layers. This framework facilitates substantial performance improvements in INT4-quantized models on the challenging MedQAUSMLE dataset. Specifically, we demonstrate a remarkable accuracy increase from 34% to 50% for the LLaMA2-70b model and from 58.77% to 69.49% for LLaMA-3.1-8b. Besides, we also proposed an effect data distillation method based on ToT. Compared to the traditional distillation method, we achieved an improvement of 86. 27% while using only 3.9% of the data.This work, for the first time, showcases the potential of ToT to significantly enhance performance on complex biomedical tasks, establishing a crucial foundation for future advances in deploying high-performing quantized LLM in resource-limited medical settings.

Yuxin Ma, Zherui Zhang, Ran Cheng et al.

In the domain of multi-objective optimization, evolutionary algorithms are distinguished by their capability to generate a diverse population of solutions that navigate the trade-offs inherent among competing objectives. This has catalyzed the ascension of evolutionary multi-objective optimization (EMO) as a prevalent approach. Despite the effectiveness of the EMO paradigm, the analysis of resultant solution sets presents considerable challenges. This is primarily attributed to the high-dimensional nature of the data and the constraints imposed by static visualization methods, which frequently culminate in visual clutter and impede interactive exploratory analysis. To address these challenges, this paper introduces ParetoLens, a visual analytics framework specifically tailored to enhance the inspection and exploration of solution sets derived from the multi-objective evolutionary algorithms. Utilizing a modularized, algorithm-agnostic design, ParetoLens enables a detailed inspection of solution distributions in both decision and objective spaces through a suite of interactive visual representations. This approach not only mitigates the issues associated with static visualizations but also supports a more nuanced and flexible analysis process. The usability of the framework is evaluated through case studies and expert interviews, demonstrating its potential to uncover complex patterns and facilitate a deeper understanding of multi-objective optimization solution sets. A demo website of ParetoLens is available at https://dva-lab.org/paretolens/.

Xingyu Wu, Yan Zhong, Jibin Wu et al.

In the algorithm selection research, the discussion surrounding algorithm features has been significantly overshadowed by the emphasis on problem features. Although a few empirical studies have yielded evidence regarding the effectiveness of algorithm features, the potential benefits of incorporating algorithm features into algorithm selection models and their suitability for different scenarios remain unclear. In this paper, we address this gap by proposing the first provable guarantee for algorithm selection based on algorithm features, taking a generalization perspective. We analyze the benefits and costs associated with algorithm features and investigate how the generalization error is affected by different factors. Specifically, we examine adaptive and predefined algorithm features under transductive and inductive learning paradigms, respectively, and derive upper bounds for the generalization error based on their model's Rademacher complexity. Our theoretical findings not only provide tight upper bounds, but also offer analytical insights into the impact of various factors, such as the training scale of problem instances and candidate algorithms, model parameters, feature values, and distributional differences between the training and test data. Notably, we demonstrate how models will benefit from algorithm features in complex scenarios involving many algorithms, and proves the positive correlation between generalization error bound and $χ^2$-divergence of distributions.

Haokai Hong, Kai Ye, Min Jiang et al.

The main feature of large-scale multi-objective optimization problems (LSMOP) is to optimize multiple conflicting objectives while considering thousands of decision variables at the same time. An efficient LSMOP algorithm should have the ability to escape the local optimal solution from the huge search space and find the global optimal. Most of the current researches focus on how to deal with decision variables. However, due to the large number of decision variables, it is easy to lead to high computational cost. Maintaining the diversity of the population is one of the effective ways to improve search efficiency. In this paper, we propose a probabilistic prediction model based on trend prediction model and generating-filtering strategy, called LT-PPM, to tackle the LSMOP. The proposed method enhances the diversity of the population through importance sampling. At the same time, due to the adoption of an individual-based evolution mechanism, the computational cost of the proposed method is independent of the number of decision variables, thus avoiding the problem of exponential growth of the search space. We compared the proposed algorithm with several state-of-the-art algorithms for different benchmark functions. The experimental results and complexity analysis have demonstrated that the proposed algorithm has significant improvement in terms of its performance and computational efficiency in large-scale multi-objective optimization.

Ye Tian, Xingyi Zhang, Cheng He et al.

In the past three decades, a large number of metaheuristics have been proposed and shown high performance in solving complex optimization problems. While most variation operators in existing metaheuristics are empirically designed, this paper aims to design new operators automatically, which are expected to be search space independent and thus exhibit robust performance on different problems. For this purpose, this work first investigates the influence of translation invariance, scale invariance, and rotation invariance on the search behavior and performance of some representative operators. Then, we deduce the generic form of translation, scale, and rotation invariant operators. Afterwards, a principled approach is proposed for the automated design of operators, which searches for high-performance operators based on the deduced generic form. The experimental results demonstrate that the operators generated by the proposed approach outperform state-of-the-art ones on a variety of problems with complex landscapes and up to 1000 decision variables.

Liang Feng, Qingxia Shang, Yaqing Hou et al.

In recent years, to improve the evolutionary algorithms used to solve optimization problems involving a large number of decision variables, many attempts have been made to simplify the problem solution space of a given problem for the evolutionary search. In the literature, the existing approaches can generally be categorized as decomposition-based methods and dimension-reduction-based methods. The former decomposes a large-scale problem into several smaller subproblems, while the latter transforms the original high-dimensional solution space into a low-dimensional space. However, it is worth noting that a given large-scale optimization problem may not always be decomposable, and it is also difficult to guarantee that the global optimum of the original problem is preserved in the reduced low-dimensional problem space. This paper thus proposes a new search paradigm, namely the multi-space evolutionary search, to enhance the existing evolutionary search methods for solving large-scale optimization problems. In contrast to existing approaches that perform an evolutionary search in a single search space, the proposed paradigm is designed to conduct a search in multiple solution spaces that are derived from the given problem, each possessing a unique landscape. The proposed paradigm makes no assumptions about the large-scale optimization problem of interest, such as that the problem is decomposable or that a certain relationship exists among the decision variables. To verify the efficacy of the proposed paradigm, comprehensive empirical studies in comparison to four state-of-the-art algorithms were conducted using the CEC2013 large-scale benchmark problems.

Zhenzhong Wang, Haokai Hong, Kai Ye et al.

Large-scale multiobjective optimization problems (LSMOPs) are characterized as involving hundreds or even thousands of decision variables and multiple conflicting objectives. An excellent algorithm for solving LSMOPs should find Pareto-optimal solutions with diversity and escape from local optima in the large-scale search space. Previous research has shown that these optimal solutions are uniformly distributed on the manifold structure in the low-dimensional space. However, traditional evolutionary algorithms for solving LSMOPs have some deficiencies in dealing with this structural manifold, resulting in poor diversity, local optima, and inefficient searches. In this work, a generative adversarial network (GAN)-based manifold interpolation framework is proposed to learn the manifold and generate high-quality solutions on this manifold, thereby improving the performance of evolutionary algorithms. We compare the proposed algorithm with several state-of-the-art algorithms on large-scale multiobjective benchmark functions. Experimental results have demonstrated the significant improvements achieved by this framework in solving LSMOPs.

Min Jiang, Guokun Chi, Geqiang Pan et al.

Robot gait optimization is the task of generating an optimal control trajectory under various internal and external constraints. Given the high dimensions of control space, this problem is particularly challenging for multi-legged robots walking in complex and unknown environments. Existing literatures often regard the gait generation as an optimization problem and solve the gait optimization from scratch for robots walking in a specific environment. However, such approaches do not consider the use of pre-acquired knowledge which can be useful in improving the quality and speed of motion generation in complex environments. To address the issue, this paper proposes a transfer learning-based evolutionary framework for multi-objective gait optimization, named Tr-GO. The idea is to initialize a high-quality population by using the technique of transfer learning, so any kind of population-based optimization algorithms can be seamlessly integrated into this framework. The advantage is that the generated gait can not only dynamically adapt to different environments and tasks, but also simultaneously satisfy multiple design specifications (e.g., speed, stability). The experimental results show the effectiveness of the proposed framework for the gait optimization problem based on three multi-objective evolutionary algorithms: NSGA-II, RM-MEDA and MOPSO. When transferring the pre-acquired knowledge from the plain terrain to various inclined and rugged ones, the proposed Tr-GO framework accelerates the evolution process by a minimum of 3-4 times compared with non-transferred scenarios.

Ke Li, Zilin Xiang, Tao Chen et al.

Cross-Project Defect Prediction (CPDP), which borrows data from similar projects by combining a transfer learner with a classifier, have emerged as a promising way to predict software defects when the available data about the target project is insufficient. How-ever, developing such a model is challenge because it is difficult to determine the right combination of transfer learner and classifier along with their optimal hyper-parameter settings. In this paper, we propose a tool, dubbedBiLO-CPDP, which is the first of its kind to formulate the automated CPDP model discovery from the perspective of bi-level programming. In particular, the bi-level programming proceeds the optimization with two nested levels in a hierarchical manner. Specifically, the upper-level optimization routine is designed to search for the right combination of transfer learner and classifier while the nested lower-level optimization routine aims to optimize the corresponding hyper-parameter settings.To evaluateBiLO-CPDP, we conduct experiments on 20 projects to compare it with a total of 21 existing CPDP techniques, along with its single-level optimization variant and Auto-Sklearn, a state-of-the-art automated machine learning tool. Empirical results show that BiLO-CPDP champions better prediction performance than all other 21 existing CPDP techniques on 70% of the projects, while be-ing overwhelmingly superior to Auto-Sklearn and its single-level optimization variant on all cases. Furthermore, the unique bi-level formalization inBiLO-CPDP also permits to allocate more budget to the upper-level, which significantly boosts the performance.

Yuqiao Liu, Yanan Sun, Bing Xue et al.

Deep Neural Networks (DNNs) have achieved great success in many applications. The architectures of DNNs play a crucial role in their performance, which is usually manually designed with rich expertise. However, such a design process is labour intensive because of the trial-and-error process, and also not easy to realize due to the rare expertise in practice. Neural Architecture Search (NAS) is a type of technology that can design the architectures automatically. Among different methods to realize NAS, Evolutionary Computation (EC) methods have recently gained much attention and success. Unfortunately, there has not yet been a comprehensive summary of the EC-based NAS algorithms. This paper reviews over 200 papers of most recent EC-based NAS methods in light of the core components, to systematically discuss their design principles as well as justifications on the design. Furthermore, current challenges and issues are also discussed to identify future research in this emerging field.

Jibin Wu, Chenglin Xu, Daquan Zhou et al.

Spiking neural networks (SNNs) have shown clear advantages over traditional artificial neural networks (ANNs) for low latency and high computational efficiency, due to their event-driven nature and sparse communication. However, the training of deep SNNs is not straightforward. In this paper, we propose a novel ANN-to-SNN conversion and layer-wise learning framework for rapid and efficient pattern recognition, which is referred to as progressive tandem learning of deep SNNs. By studying the equivalence between ANNs and SNNs in the discrete representation space, a primitive network conversion method is introduced that takes full advantage of spike count to approximate the activation value of analog neurons. To compensate for the approximation errors arising from the primitive network conversion, we further introduce a layer-wise learning method with an adaptive training scheduler to fine-tune the network weights. The progressive tandem learning framework also allows hardware constraints, such as limited weight precision and fan-in connections, to be progressively imposed during training. The SNNs thus trained have demonstrated remarkable classification and regression capabilities on large-scale object recognition, image reconstruction, and speech separation tasks, while requiring at least an order of magnitude reduced inference time and synaptic operations than other state-of-the-art SNN implementations. It, therefore, opens up a myriad of opportunities for pervasive mobile and embedded devices with a limited power budget.

Qiang Yu, Shiming Song, Chenxiang Ma et al.

Traditional neuron models use analog values for information representation and computation, while all-or-nothing spikes are employed in the spiking ones. With a more brain-like processing paradigm, spiking neurons are more promising for improvements on efficiency and computational capability. They extend the computation of traditional neurons with an additional dimension of time carried by all-or-nothing spikes. Could one benefit from both the accuracy of analog values and the time-processing capability of spikes? In this paper, we introduce a concept of augmented spikes to carry complementary information with spike coefficients in addition to spike latencies. New augmented spiking neuron model and synaptic learning rules are proposed to process and learn patterns of augmented spikes. We provide systematic insight into the properties and characteristics of our methods, including classification of augmented spike patterns, learning capacity, construction of causality, feature detection, robustness and applicability to practical tasks such as acoustic and visual pattern recognition. The remarkable results highlight the effectiveness and potential merits of our methods. Importantly, our augmented approaches are versatile and can be easily generalized to other spike-based systems, contributing to a potential development for them including neuromorphic computing.

Qiang Yu, Chenxiang Ma, Shiming Song et al.

Spiking neural networks (SNNs) are considered as a potential candidate to overcome current challenges such as the high-power consumption encountered by artificial neural networks (ANNs), however there is still a gap between them with respect to the recognition accuracy on practical tasks. A conversion strategy was thus introduced recently to bridge this gap by mapping a trained ANN to an SNN. However, it is still unclear that to what extent this obtained SNN can benefit both the accuracy advantage from ANN and high efficiency from the spike-based paradigm of computation. In this paper, we propose two new conversion methods, namely TerMapping and AugMapping. The TerMapping is a straightforward extension of a typical threshold-balancing method with a double-threshold scheme, while the AugMapping additionally incorporates a new scheme of augmented spike that employs a spike coefficient to carry the number of typical all-or-nothing spikes occurring at a time step. We examine the performance of our methods based on MNIST, Fashion-MNIST and CIFAR10 datasets. The results show that the proposed double-threshold scheme can effectively improve accuracies of the converted SNNs. More importantly, the proposed AugMapping is more advantageous for constructing accurate, fast and efficient deep SNNs as compared to other state-of-the-art approaches. Our study therefore provides new approaches for further integration of advanced techniques in ANNs to improve the performance of SNNs, which could be of great merit to applied developments with spike-based neuromorphic computing.

Qiang Yu, Shenglan Li, Huajin Tang et al.

Spikes are the currency in central nervous systems for information transmission and processing. They are also believed to play an essential role in low-power consumption of the biological systems, whose efficiency attracts increasing attentions to the field of neuromorphic computing. However, efficient processing and learning of discrete spikes still remains as a challenging problem. In this paper, we make our contributions towards this direction. A simplified spiking neuron model is firstly introduced with effects of both synaptic input and firing output on membrane potential being modeled with an impulse function. An event-driven scheme is then presented to further improve the processing efficiency. Based on the neuron model, we propose two new multi-spike learning rules which demonstrate better performance over other baselines on various tasks including association, classification, feature detection. In addition to efficiency, our learning rules demonstrate a high robustness against strong noise of different types. They can also be generalized to different spike coding schemes for the classification task, and notably single neuron is capable of solving multi-category classifications with our learning rules. In the feature detection task, we re-examine the ability of unsupervised STDP with its limitations being presented, and find a new phenomenon of losing selectivity. In contrast, our proposed learning rules can reliably solve the task over a wide range of conditions without specific constraints being applied. Moreover, our rules can not only detect features but also discriminate them. The improved performance of our methods would contribute to neuromorphic computing as a preferable choice.

Ke Li, Zilin Xiang, Tao Chen et al.

Data-driven defect prediction has become increasingly important in software engineering process. Since it is not uncommon that data from a software project is insufficient for training a reliable defect prediction model, transfer learning that borrows data/knowledge from other projects to facilitate the model building at the current project, namely cross-project defect prediction (CPDP), is naturally plausible. Most CPDP techniques involve two major steps, i.e., transfer learning and classification, each of which has at least one parameter to be tuned to achieve their optimal performance. This practice fits well with the purpose of automated parameter optimization. However, there is a lack of thorough understanding about what are the impacts of automated parameter optimization on various CPDP techniques. In this paper, we present the first empirical study that looks into such impacts on 62 CPDP techniques, 13 of which are chosen from the existing CPDP literature while the other 49 ones have not been explored before. We build defect prediction models over 20 real-world software projects that are of different scales and characteristics. Our findings demonstrate that: (1) Automated parameter optimization substantially improves the defect prediction performance of 77\% CPDP techniques with a manageable computational cost. Thus more efforts on this aspect are required in future CPDP studies. (2) Transfer learning is of ultimate importance in CPDP. Given a tight computational budget, it is more cost-effective to focus on optimizing the parameter configuration of transfer learning algorithms (3) The research on CPDP is far from mature where it is "not difficult" to find a better alternative by making a combination of existing transfer learning and classification techniques. This finding provides important insights about the future design of CPDP techniques.

Jibin Wu, Emre Yilmaz, Malu Zhang et al.

Artificial neural networks (ANN) have become the mainstream acoustic modeling technique for large vocabulary automatic speech recognition (ASR). A conventional ANN features a multi-layer architecture that requires massive amounts of computation. The brain-inspired spiking neural networks (SNN) closely mimic the biological neural networks and can operate on low-power neuromorphic hardware with spike-based computation. Motivated by their unprecedented energyefficiency and rapid information processing capability, we explore the use of SNNs for speech recognition. In this work, we use SNNs for acoustic modeling and evaluate their performance on several large vocabulary recognition scenarios. The experimental results demonstrate competitive ASR accuracies to their ANN counterparts, while require significantly reduced computational cost and inference time. Integrating the algorithmic power of deep SNNs with energy-efficient neuromorphic hardware, therefore, offer an attractive solution for ASR applications running locally on mobile and embedded devices.