Many optimization tasks involve streaming data with unknown concept drifts, posing a significant challenge as Streaming Data-Driven Optimization (SDDO). Existing methods, while leveraging surrogate model approximation and historical knowledge transfer, are often under restrictive assumptions such as fixed drift intervals and fully environmental observability, limiting their adaptability to diverse dynamic environments. We propose TRACE, a TRAnsferable Concept-drift Estimator that effectively detects distributional changes in streaming data with varying time scales. TRACE leverages a principled tokenization strategy to extract statistical features from data streams and models drift patterns using attention-based sequence learning, enabling accurate detection on unseen datasets and highlighting the transferability of learned drift patterns. Further, we showcase TRACE's plug-and-play nature by integrating it into a streaming optimizer, facilitating adaptive optimization under unknown drifts. Comprehensive experimental results on diverse benchmarks demonstrate the superior generalization, robustness, and effectiveness of our approach in SDDO scenarios.
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Bidirectional Noise Injection: Enhancing Diffusion Models via Coordinated Input-Output Perturbation
PDF ↗Diffusion models have demonstrated remarkable success in image generation, yet a persistent challenge remains: the bias between model predictions and the target distribution. In this paper, we propose a Bidirectional Noise Injection framework for enhancing diffusion models, implemented via Coordinated Input-Output Perturbation (CIOP). Our approach mitigates this bias by randomly applying synchronized noise injection to both the model inputs and the prediction targets during the training stage. This stochastic, synchronized noise injected acts as a smoothing mechanism that effectively reduces the 2-Wasserstein distance between the predicted and target distributions, as substantiated by our theoretical analysis based on optimal transport theory. Extensive experiments on multiple benchmark datasets and various generative tasks demonstrate that our method improves generation quality and training efficiency without incurring additional computational cost. Furthermore, the design of CIOP enables seamless integration with existing diffusion model improvements and advanced frameworks, thereby broadening its applicability. These results highlight the potential of Bidirectional Noise Injection via CIOP to alleviate bias in diffusion-based generative models across a wide range of settings.
Deep multi-view clustering (MVC) methods achieve impressive performance by effectively capturing complementary information across views, where feature fusion serves as the critical mechanism for maximizing cross-view complementarity. However, most existing methods suffer from rigid dependence on non-adaptive predefined fusion operations, resulting in unverifiable and potentially suboptimal fused feature quality. To resolve these limitations, we propose a novel multi-view clustering framework that learns adaptive hierarchical fusion through an unsupervised evolutionary algorithm. Unlike conventional predefined-fusion strategies, our approach employs tree-structured representations (Fusion Trees) for adaptive feature integration. These Fusion Trees are optimized via our evolutionary mechanism, in which models sharing identical architectures but distinct Fusion Trees are conceptualized as evolutionary individuals. Through implementation of the evolutionarily optimized Fusion Tree, the resultant model generates discriminative representations in accordance with biological evolutionary principles. Comprehensive benchmarking across twelve multi-view datasets validates significant performance gains improvement over state-of-the-art baselines.
Break the Tie: Learning Cluster-Customized Category Relationships for Categorical Data Clustering
PDF ↗Categorical attributes with qualitative values are ubiquitous in cluster analysis of real datasets. Unlike the Euclidean distance of numerical attributes, the categorical attributes lack well-defined relationships of their possible values (also called categories interchangeably), which hampers the exploration of compact categorical data clusters. Although most attempts are made for developing appropriate distance metrics, they typically assume a fixed topological relationship between categories when learning distance metrics, which limits their adaptability to varying cluster structures and often leads to suboptimal clustering performance. This paper, therefore, breaks the intrinsic relationship tie of attribute categories and learns customized distance metrics suitable for flexibly and accurately revealing various cluster distributions. As a result, the fitting ability of the clustering algorithm is significantly enhanced, benefiting from the learnable category relationships. Moreover, the learned category relationships are proved to be Euclidean distance metric-compatible, enabling a seamless extension to mixed datasets that include both numerical and categorical attributes. Comparative experiments on 12 real benchmark datasets with significance tests show the superior clustering accuracy of the proposed method with an average ranking of 1.25, which is significantly higher than the 5.21 ranking of the best-performing methods. Code and extended version with detailed proofs are provided online.
Understanding enzyme thermal properties is essential for biotechnology and protein engineering, yet experimental measurements of attributes such as temperature optimum, stability, and range remain labor-intensive and costly. Prior studies have shown that specific regions within enzyme sequences disproportionately influence thermal behavior—an aspect often overlooked by existing deep learning models. In this work, we introduce PatchET, a biologically inspired deep learning model that predicts enzyme thermal properties directly from amino acid sequences. PatchET employs a dual-stage, patch-based architecture that captures both intra-patch local features and inter-patch global dependencies, reflecting the hierarchical nature of protein thermal adaptation. Alongside the model, we curate a comprehensive benchmark, including a refined dataset for temperature optimum and the first publicly available dataset for temperature range prediction. PatchET achieves state-of-the-art performance across three key tasks—temperature optimum, stability, and range—and serves as the first dedicated model for temperature range prediction. Extensive ablation studies further validate the effectiveness of our architectural design. Together, PatchET and the accompanying benchmark provide a unified and generalizable framework for modeling enzyme thermal properties, offering new tools for the rational design of thermostable enzymes.
Ordinal classification has been widely applied in many high-stakes applications, e.g., medical imaging and diagnosis, where reliable uncertainty quantification (UQ) is essential for decision making. Conformal prediction (CP) is a general UQ framework that provides statistically valid guarantees, which is especially useful in practice. However, prior ordinal CP methods mainly focus on heuristic algorithms or restrictively require the underlying model to predict a unimodal distribution over ordinal labels. Consequently, they provide limited insight into coverage–efficiency trade-offs, or a model-agnostic and distribution-free nature favored by CP methods. To this end, we fill this gap by propose an ordinal-CP method that is model-agnostic and provides instance-level optimal prediction intervals. Specifically, we formulate conformal ordinal classification as a minimum-length covering problem at the instance level. To solve this problem, we develop a sliding-window algorithm that is optimal on each calibration data, with only a linear time complexity in K, the # of label candidates. The local optimality per instance further also improves predictive efficiency in expectation. Moreover, we propose a length-regularized variant that shrinks prediction set size while preserving coverage. Experiments on four benchmark datasets from diverse domains are conducted to demonstrate the significantly improved predictive efficiency of the proposed methods over baselines (by 15%↓ on average over four datasets).
The success of large language models (LLMs) in cognitive tasks prompts the question of whether their next-token prediction (NTP) paradigm can be adapted to model physiological signals from wearable devices. A key target for this adaptation is photoplethysmography (PPG), the most prevalent sensing modality in consumer wearables for non-invasive monitoring of diverse physiological conditions. Unlike in NLP, where NTP aligns with generative objectives, physiological signal analysis involves fundamentally different tasks, such as continuous parameter estimation (regression) and discrete state recognition (classification). This disparity creates a semantic mismatch between the pre-training paradigm and the downstream tasks. To bridge this gap, we propose PPGPT, the first foundation model that reformulates NTP into next-feature token prediction (NFTP), learning hierarchical feature transition probabilities to unify pre-training and downstream objectives. PPGPT features a novel dual-stream encoder that generates feature tokens by jointly modeling temporal dynamics and local-global morphological patterns. The model is developed using a two-stage training framework: it is first pre-trained on a large-scale mixed dataset of 1.6 billion data points and then validated on our newly released BioMTL benchmark, which includes data from 172 subjects over 285 days across seven different tasks. Extensive experiments show that PPGPT significantly outperforms competing methods, achieving a 16.5% improvement in F1-score and a 25.9% reduction in Mean Absolute Error (MAE). Furthermore, the model demonstrates robust few-shot learning capabilities.
Fairness concerns are increasingly critical as machine learning models are deployed in high-stakes applications. While existing fairness-aware methods typically intervene at the model level, they often suffer from high computational costs, limited scalability, and poor generalization. To address these challenges, we propose a Bayesian data selection framework that ensures fairness by aligning group-specific posterior distributions of model parameters and sample weights with a shared central distribution. Our framework supports flexible alignment via various distributional discrepancy measures, including Wasserstein distance, maximum mean discrepancy, and f-divergence, allowing geometry-aware control without imposing explicit fairness constraints. This data-centric approach mitigates group-specific biases in training data and improves fairness in downstream tasks, with theoretical guarantees. Experiments on benchmark datasets show that our method consistently outperforms existing data selection and model-based fairness methods in both fairness and accuracy.
Unifying Channel Independence and Mixing: Multi-Scale Patch Recursion for Global–Local Representation Synergy in Multivariate Time Series Forecasting
PDF ↗Multivariate time series forecasting underpins applications in finance, meteorology, and industrial operations. Yet two persistent hurdles remain: (i) models typically choose between Channel–Independent (CI) and Channel–Mixed (CM) formulations—each with distinct strengths—leading to large performance variance across datasets; and (ii) short-term dynamics and long-term trends are hard to model jointly, making it difficult to capture both transient bursts and periodic patterns. We propose FusionTimePatch (FTP), a purely MLP-driven, lightweight framework composed of three modules: (1) Dual-View Global–Local Fusion (Dual-GLF), which runs CI and CM views in parallel and employs multi-scale patch recursion to adaptively adjust the look-back window, thereby coupling global tendencies with local details; (2) Channel Enhancement (CE), which adaptively identifies and amplifies salient channel signals and diffuses them to others, improving sensitivity to abrupt events and latent drivers; and (3) a Linear Fusion layer, which unifies Dual-GLF and CE outputs to strengthen cross-view interactions and enhance robustness. Extensive experiments on multiple public benchmarks show FTP consistently surpasses state-of-the-art counterparts in both accuracy and efficiency, offering a scalable new paradigm for multichannel forecasting. Code and datasets are publicly available at https://github.com/Zhveh7/FTP.
The ability to perform multi-modal multi-hop reasoning by iteratively integrating information across various modalities and external knowledge is critical for addressing complex real-world challenges. However, existing Multi-modal Large Language Models (MLLMs) are predominantly limited to single-step reasoning, as existing benchmarks lack the complexity needed to evaluate and drive multi-hop abilities. To bridge this gap, we introduce MMhops, a novel, large-scale benchmark designed to systematically evaluate and foster multi-modal multi-hop reasoning. MMhops dataset comprises two challenging task formats, Bridging and Comparison, which necessitate that models dynamically construct complex reasoning chains by integrating external knowledge. To tackle the challenges posed by MMhops, we propose MMhops-R1, a novel multi-modal Retrieval-Augmented Generation (mRAG) framework for dynamic reasoning. Our framework utilizes reinforcement learning to optimize the model for autonomously planning reasoning paths, formulating targeted queries, and synthesizing multi-level information. Comprehensive experiments demonstrate that MMhops-R1 significantly outperforms strong baselines on MMhops, highlighting that dynamic planning and multi-modal knowledge integration are crucial for complex reasoning. Moreover, MMhops-R1 demonstrates strong generalization to tasks requiring fixed-hop reasoning, underscoring the robustness of our dynamic planning approach.
Cross-modal hashing has emerged as a pivotal solution for efficient retrieval across diverse modalities, such as images and texts, by mapping them into compact binary hash spaces. However, in real-world scenarios, the modalities data is often missing or misaligned. Existing methods are most rely on fully paired training data and ignore missing or misaligned modalities data, resulting in the semantic inconsistencies. To address these challenges, we propose an Adaptive Graph Attention-Based Discrete Hashing (AGADH) method, which consists of three parts. First, to solve the problem of missing modalities, AGADH employs a masked completion strategy to reconstruct missing modalities. Second, to mitigate semantic misalignment, AGADH leverages a Graph Attention Network (GAT) encoder-decoder architecture with alignment module to construct features from different modalities. Additionally, to enhance the fusion performance, an adaptive fusion module dynamically adjusting the contributions of image and text modalities with learnable weighting coefficients is proposed. Extensive experiments on three benchmark datasets, MS-COCO, NUS-WIDE, and MIRFlickr-25K, demonstrating that AGADH outperforms state-of-the-art methods in both fully paired and incompletely paired scenarios, showing its robustness and effectiveness in cross-modal retrieval tasks.
Multiple clustering aims to uncover diverse latent structures within the data, enabling a more comprehensive understanding of complex datasets. However, existing approaches either heavily rely on user-supplied keywords or disregard user-interested clustering types, limiting the ability to discover the full range of explainable clusterings of interests, particularly in high-dimensional settings. Furthermore, existing methods insufficiently leverage the rich textual semantics and fall short in fully integrating multi-modal information. To address these challenges, we propose MLLM enriched Multiple Clustering (MLLMMC), a novel framework that leverages multi-modal large language model (MLLM) to explore explainable non-redundant clustering. Specifically, MLLMMC first employs MLLM to generate sample descriptions, which serve as input for LLM to perform prompt-driven reasoning and infer latent clustering types, and then merges them with user-interested types to obtain diverse and explainable clustering types. For each selected type, MLLMMC utilizes MLLM to generate sample-level textual descriptions and aligns them with corresponding visual features through a cross-attention fusion module, which produces a semantically aligned and enriched representation for the target clustering type. Extensive experiments on six benchmark datasets from diverse domains demonstrate that MLLMMC achieves diverse, explainable, and high-quality clustering outcomes, outperforming state-of-the-art multiple clustering methods with a large margin.
MDMLP-EIA: Multi-domain Dynamic MLPs with Energy Invariant Attention for Time Series Forecasting
PDF ↗Time series forecasting is essential across diverse domains. While MLP-based methods have gained attention for achieving Transformer-comparable performance with fewer parameters and better robustness, they face critical limitations including loss of weak seasonal signals, capacity constraints in weight-sharing MLPs, and insufficient channel fusion in channel-independent strategies. To address these challenges, we propose MDMLP-EIA (Multi-domain Dynamic MLPs with Energy Invariant Attention) with three key innovations. First, we develop an adaptive fused dual-domain seasonal MLP that categorizes seasonal signals into strong and weak components. It employs an adaptive zero-initialized channel fusion strategy to minimize noise interference while effectively integrating predictions. Second, we introduce an energy invariant attention mechanism that adaptively focuses on different feature channels within trend and seasonal predictions across time steps. This mechanism maintains constant total signal energy to align with the decomposition-prediction-reconstruction framework and enhance robustness against disturbances. Third, we propose a dynamic capacity adjustment mechanism for channel-independent MLPs. This mechanism scales neuron count with the square root of channel count, ensuring sufficient capacity as channels increase. Extensive experiments across nine benchmark datasets demonstrate that MDMLP-EIA achieves state-of-the-art performance in both prediction accuracy and computational efficiency.
Recent vision-language models (VLMs) show strong reasoning capabilities through training with reinforcement learning from verifiable rewards (RLVR). Despite their impressive capabilities, current VLMs focus on a limited range of reasoning tasks, such as mathematical and logical reasoning, due to the lack of readily available verifiable reward data in broader domains. As a result, these models struggle to generalize their reasoning abilities to the wide variety of challenges encountered in real-world environments. To address this limitation, we collect and assemble a comprehensive RL-ready visual reasoning training dataset encompassing 46 datasets across 13 dimensions of 5 domains, covering a wide range of realistic scenarios such as infographic reasoning, mathematical reasoning, spatial reasoning, and general science reasoning. Based on this dataset, we propose an influence function-based data filtering strategy and a multi-round data curriculum method to iteratively strengthen general visual reasoning abilities. Using this approach, we train a general reasoning VLM, namely Vision-G1. Our 7B model achieves state-of-the-art performance across nine visual reasoning benchmarks, surpassing previous similar-sized VLMs and even GPT-4o and Gemini-1.5 Flash.
Personalized Federated Learning (PFL), which aims to customize models for each client while preserving data privacy, has become an important research topic in addressing the challenges of data heterogeneity. Existing studies usually enhance the localization of global parameters by injecting local information into the globally shared model. However, these methods focus excessively on the personalized characteristics of individual clients and fail to fully exploit distinctive information across clients, limiting the quality of local models to represent unseen samples well. To address this issue, we propose a novel personalized Federated Privacy-preserving Knowledge Dynamic Alignment (FedPKDA) framework, which ensures data privacy during both the collection of client-side key information and its incorporation into federated model training. Specifically, to ensure data privacy during the cross-client information collection phase, we first conduct feature clipping and add Laplacian noise to the local prototypes extracted from each client. Further, we compute the centroid of the uploaded local prototypes in a latent space and leverage Mahalanobis distance to guide the generation of global prototypes, thereby preserving the semantic contributions from participating clients. Moreover, to boost the personalization of the local model, we dynamically align representations learned by the shared model with both a set of local prototypes and privacy-preserving global prototypes, facilitating effective cross-client knowledge sharing under heterogeneous settings while preserving client-specific characteristics. Extensive experiments on benchmark datasets have verified the superiority of FedPKDA against its competitors.
Demystifying GNN-to-MLP Knowledge Transfer: Theoretical Grounding and Dual-Stream Distillation Method
PDF ↗Graph Neural Networks (GNNs) have shown remarkable effectiveness across various applications, but their computational complexity poses significant scalability challenges. To this end, GNN-to-MLP Knowledge Distillation (KD) methods transfer relational inductive biases from GNNs to MLPs, equipping MLPs with graph-aware capabilities that rival or even surpass those of their teacher GNNs. However, a theoretical foundation for understanding GNN-to-MLP KD is still missing. In this paper, we provide a theoretical analysis of how knowledge distillation unlocks the potential of MLPs for graph tasks from the perspective of training dynamics. We demonstrate that label alignment in KD fundamentally reshapes the Neural Tangent Kernel (NTK) matrix of student MLPs, enabling them to learn the teacher model’s implicit graph bias. We further investigate finer-grained distillation paradigms and reveal that conventional layer-wise output alignment fails to effectively align the deep-layer graph propagation outcomes. To address this, we propose Dual-Stream Aligned MLP (DA-MLP), which incorporates complementary graph filters in a dual-stream architecture. This approach simultaneously enhances feature space dimensionality for improved representation alignment and preserves graph signals across different frequency bands. Comprehensive experiments on seven benchmark datasets validate that DA-MLP can be seamlessly integrated into existing knowledge distillation frameworks for performance enhancements in both transductive and inductive settings.
TVChain: Leveraging Textual-Visual Prompt Chains for Jailbreaking Large Vision-Language Models
PDF ↗Large Vision-Language Models (LVLMs) enhance the capabilities of Large Language Models by integrating visual inputs, thereby enabling advanced multimodal reasoning across diverse applications. However, these enhanced reasoning capabilities introduce new security risks, particularly to jailbreaking attacks that bypass built-in safety mechanisms to elicit harmful or unauthorized outputs. While recent efforts have explored adversarial and typographic prompts, most existing attacks suffer from three key limitations: reliance on auxiliary models, limited effectiveness in black-box scenarios, and inadequate exploitation of the LVLMs' intrinsic reasoning abilities. In this work, we propose TVChain, a novel black-box jailbreaking framework that explicitly intervenes in both the visual and textual reasoning processes of LVLMs. TVChain decomposes malicious prompts into a sequence of semantically meaningful sub-images that represent relevant objects and behaviors, thereby circumventing direct exposure of illicit content. In parallel, a carefully designed chain-of-thought (CoT) textual prompt is employed to steer the model's reasoning toward reconstructing the intended activity in a covert yet effective manner. We demonstrate that this compositional prompting strategy reduces the likelihood of triggering safety mechanisms while preserving attack efficacy. Extensive evaluations on eleven LVLMs (seven open-source and four commercial) across two benchmark datasets and three state-of-the-art defenses validate the effectiveness and robustness of TVChain.
Despite the great performance of deep learning models in many areas, they still make mistakes and underperform on certain subsets of data, i.e. error slices. Given a trained model, it is important to identify its semantically coherent error slices that are easy to interpret, which is referred to as the error slice discovery problem. However, there is no proper metric of slice coherence without relying on extra information like predefined slice labels. Current evaluation of slice coherence requires access to predefined slices formulated by metadata like attributes or subclasses. Its validity heavily relies on the quality and abundance of metadata, where some possible patterns could be ignored. Besides, current algorithms cannot directly incorporate the constraint of coherence into their optimization objective due to absence of an explicit coherence metric, which could potentially hinder their effectiveness. In this paper, we propose manifold compactness, a coherence metric without reliance on extra information by incorporating the data geometry property into its design, and experiments on typical datasets empirically validate the rationality of the metric. Then we develop Manifold Compactness based error Slice Discovery (MCSD), a novel algorithm that directly treats risk and coherence as the optimization objective, and is flexible to be applied to models of various tasks. Extensive experiments on the benchmark and case studies on other typical datasets demonstrate the superiority of MCSD.
Survival prediction of cancers is crucial for clinical practice, as it informs mortality risks and influences treatment plans. However, a static model trained on a single dataset fails to adapt to the dynamically evolving clinical environment and continuous data streams, limiting its practical utility. While continual learning (CL) offers a solution to learn dynamically from new datasets, existing CL methods primarily focus on unimodal inputs and suffer from severe catastrophic forgetting in survival prediction. In real-world scenarios, multimodal inputs often provide comprehensive and complementary information, such as whole slide images and genomics; and neglecting inter-modal correlations negatively impacts the performance. To address the two challenges of catastrophic forgetting and complex inter-modal interactions between gigapixel whole slide images and genomics, we propose ConSurv, the first multimodal continual learning (MMCL) method for survival analysis. ConSurv incorporates two key components: Multi-staged Mixture of Experts (MS-MoE) and Feature Constrained Replay (FCR). MS-MoE captures both task-shared and task-specific knowledge at different learning stages of the network, including two modality encoders and the modality fusion component, learning inter-modal relationships. FCR further enhances learned knowledge and mitigates forgetting by restricting feature deviation of previous data at different levels, including encoder-level features of two modalities and the fusion-level representations. Additionally, we introduce a new benchmark integrating four datasets, Multimodal Survival Analysis Incremental Learning (MSAIL), for comprehensive evaluation in the CL setting. Extensive experiments demonstrate that ConSurv outperforms competing methods across multiple metrics.
Model robustness indicates a model’s capability to generalize well on unforeseen distributional shifts, including data corruptions and adversarial attacks. Data augmentation is one of the most prevalent and effective ways to enhance robustness. Despite the great success of the diverse augmentations in different fields, a unified theoretical understanding of their efficacy in improving model robustness is lacking. We theoretically reveal a general condition for label-preserving augmentations to bring robustness to diverse distribution shifts through the lens of flat minima and generalization bound, which de facto turns out to be strongly correlated with robustness against different distribution shifts in practice. Unlike most earlier works, our theoretical framework accommodates all the label-preserving augmentations and is not limited to particular distribution shifts. We substantiate our theories through different simulations on the existing common corruption and adversarial robustness benchmarks based on the CIFAR and ImageNet datasets.