论文检索

General Machine Learning · Representation Learning

Haitao YU, Min Nan, Zheng Fang, Hongyu Zhan, Yusen Tan, Yuhan Wang, Jun Xia

Inferring molecular structures from multimodal spectroscopic measurements requires integrating complementary yet highly heterogeneous signals. However, the common paradigm of directly concatenating multispectral sequences can exhibit anomalous performance degradation, primarily due to pronounced heterogeneity and the resulting multimodal imbalance across modalities. As a remedy, we propose MM-Spectrum, a sparse Mixture-of-Experts framework tailored for multimodal multispectral spectra-to-structure elucidation. To better match the information characteristics under multispectral imbalance, MM-Spectrum introduces an explicit modality-aware routing mechanism that exposes spectral identity to the router in addition to token content representations. Moreover, it incorporates shared and interaction experts, together with heterogeneous expert capacities, to extract multispectral modality-unique and cross-modal synergistic information while suppressing noise-induced interference. Across full-modality, bimodal, and missing-modality settings on molecular structural elucidation, MM-Spectrum achieves consistent and substantial improvements, supported by ablation studies and interpretability analyses. Code is available at https://anonymous.4open.science/r/MM-Spectrum-1727.

Deep Learning · Attention Mechanisms

Hyunchan Moon, Cheonjun Park, Steven Waslander

Vision Transformers (ViTs) have achieved remarkable success across various vision tasks, yet their deployment is often hindered by prohibitive computational costs. While structured weight pruning and token compression have emerged as promising solutions, they suffer from prolonged retraining times and global propagation that creates optimization challenges, respectively. We propose ToaSt, a decoupled framework applying specialized strategies to distinct ViT components. We apply coupled head-wise structured pruning to Multi-Head Self-Attention modules, leveraging attention operation characteristics to enhance robustness. For Feed-Forward Networks (over 60\% of FLOPs), we introduce Token Channel Selection (TCS) that enhances compression ratios while avoiding global propagation issues. Our analysis reveals TCS effectively filters redundant noise during selection. Extensive evaluations across nine diverse models, including DeiT, ViT-MAE, and Swin Transformer, demonstrate that ToaSt achieves superior trade-offs between accuracy and efficiency, consistently outperforming existing baselines. On ViT-MAE-Huge, ToaSt achieves 88.52\% accuracy (+1.64 \%) with 39.4\% FLOPs reduction. ToaSt transfers effectively to downstream tasks, achieving 52.2 versus 51.9 mAP on COCO object detection. Code and models will be released upon acceptance.

Applications · Robotics

Xianzhe Fan, Shengliang Deng, Xiaoyang Wu, Yuxiang Lu, Zhuoling Li, Mi Yan, Yujia Zhang, Zhizheng Zhang, He Wang, Hengshuang Zhao

Existing Vision-Language-Action (VLA) models typically take 2D images as visual input, which limits their spatial understanding in complex scenes. How can we incorporate 3D information to enhance VLA capabilities? We conduct a pilot study across different observation spaces and visual representations. The results show that explicitly lifting visual input into point clouds yields representations that better complement their corresponding 2D representations. To address the challenges of (1) scarce 3D data and (2) the domain gap induced by cross-environment differences and depth-scale biases, we propose Any3D-VLA. It unifies the simulator, sensor, and model-estimated point clouds within a training pipeline, constructs diverse inputs, and learns domain-agnostic 3D representations that are fused with the corresponding 2D representations. Simulation and real-world experiments demonstrate Any3D-VLA's advantages in improving performance and mitigating the domain gap. Our code is available at https://anonymous.4open.science/r/Any3D-VLA-anonymous.

Theory · Game Theory

Renato Leme, Clifford Stein, Yifeng Teng, Pratik Worah

We design efficient approximation algorithms for maximizing the expectation of the supremum of families of Gaussian random variables. In particular, let $OPT:=\max_{\sigma_1,\cdots,\sigma_n}\mathbb{E}\sum_{j=1}^{m}\max_{i\in S_j} X_i$, where $X_i$ are Gaussian, $S_j\subset[n]$ and $\sum_i\sigma_i^2=1$, then our theoretical results include: - We characterize the optimal variance allocation -- it concentrates on a small subset of variables as $|S_j|$ increases, - A polynomial time approximation scheme (PTAS) for computing OPT when $m=1$, and - An $O(\log n)$ approximation algorithm for computing OPT for general $m>1$.

Deep Learning · Generative Models and Autoencoders

Haobo Li, Yanhong Zeng, Yunhong Lu, Jiapeng Zhu, Hao Ouyang, Qiuyu Wang, Ka Leong Cheng, Yujun Shen, Zhipeng Zhang

We present \textbf{AAD-1}, an \textbf{A}symmetric \textbf{A}dversarial \textbf{D}istillation framework for \textbf{O}ne-step autoregressive image-to-video generation. State-of-the-art methods adopt adversarial distillation but suffer from motion collapse and training instability, resulting in static videos. AAD-1 addresses these challenges through two key designs in architecture and training strategy. Our key architectural insight is to break the symmetry between generator and discriminator. While the generator remains causal to preserve autoregressive sampling capability, the discriminator attends bidirectionally over the full spatiotemporal context and produces a single holistic realism score for the entire video sequence. This asymmetric design enables the discriminator to effectively detect global temporal failures and long-range drift that cause motion collapse in autoregressive generation. To stabilize training, we introduce a phased strategy that first uses distribution matching to bootstrap a stable one-step generator, providing a warm-up phase that brings the student distribution closer to the teacher before adversarial distillation begins. Extensive experiments on VBench demonstrate that AAD-1 achieves state-of-the-art performance in one-step autoregressive video generation.

Deep Learning · Large Language Models

Ibraheem Muhammad Moosa, Suhas Lohit, Ye Wang, Moitreya Chatterjee, Wenpeng Yin

Token-level adaptive computation seeks to reduce inference cost by allocating more computation to harder tokens and less to easier ones. However, prior work is primarily evaluated on natural-language benchmarks using task-level metrics, where token-level difficulty is unobservable and confounded with architectural factors, making it unclear whether compute allocation truly aligns with underlying complexity. We address this gap through three contributions. First, we introduce a complexity-controlled evaluation paradigm using algorithmic and synthetic language tasks with parameterized difficulty, enabling direct testing of token-level compute allocation. Second, we propose ANIRA, a unified recurrent Transformer framework that supports per-token variable-depth computation while isolating compute allocation decisions from other model factors. Third, we use this framework to conduct a systematic analysis of token-level adaptive computation across alignment with complexity, generalization, and decision timing. Our results show that compute allocation aligned with task complexity can emerge without explicit difficulty supervision, but such alignment does not imply algorithmic generalization: models fail to extrapolate to unseen input sizes despite allocating additional computation. We further find that early compute decisions rely on static structural cues, whereas online halting more closely tracks algorithmic execution state.

Optimization · Everything Else

Gal Lifshitz, Shahar Zuler, Ori Fouks, Dan Raviv

End-to-end deep learning has achieved impressive results but often relies on large labeled datasets, exhibits limited generalization to unseen scenarios, and incurs substantial computational cost. Classical optimization methods, in contrast, are data-efficient and lightweight but frequently suffer from slow or unstable convergence. Learned optimizers aim to bridge this gap, yet existing approaches predominantly focus on first-order methods, leaving learned second-order optimization largely unexplored. We introduce L-SR1, a novel learned second-order optimizer that augments the classical Symmetric Rank-One (SR1) method with a lightweight, trainable preconditioning unit. This unit generates data-driven rank-one updates that are explicitly aligned with the secant condition via a learned projection mechanism, ensuring stable and consistent curvature estimation. Through controlled analytic benchmarks, we systematically analyze the stability, generalization across problem dimensions, and the quality of the resulting search directions. We further evaluate L-SR1 on the real-world task of Monocular Human Mesh Recovery (HMR), where it outperforms existing optimization-based and learned-optimization baselines. With a compact model and no reliance on task-specific fine-tuning or annotated data, L-SR1 demonstrates strong generalization and provides an effective drop-in optimizer for a wide range of iterative optimization problems.

General Machine Learning · Sequential, Network, and Time Series Modeling

Wencheng Zhang, Long Li, Huayi Qin, Zongjuan Wu, Jing Li, Wanghu Chen

Effective time series representation is critical for revealing temporal dynamics in many fields. However, existing approaches encounter fundamental limitations. Discrete-time representations struggle with irregular sampling and the tradeoff of fidelity and efficiency, while traditional implicit neural representations suffer from spectral bias and frequency entanglement. To address these challenges, we conceptualize time series as the superposition of continuous trends and discrete events from a continuous-time perspective and propose DualTimesField, a framework that utilizes dual implicit neural fields. Its Continuous Time Field captures smooth trends through bandwidth-limited parameterization, while a Discrete Geometric Field models transient events using learnable Gabor atoms, gated sparsity, and coarse-to-fine scale annealing. This explicit field separation effectively overcomes both limitations. Experiments on nine real-world benchmarks demonstrate substantial improvements in representation fidelity, achieving 51.2% average MSE reduction over discrete-time baselines and competitive interpolation on irregular data. Code is available at https://anonymous.4open.science/r/DualTimesField-AF32.

Theory · Deep Learning

Shengtai Yao, Eitan Levin, Mateo Diaz

Several machine learning models are defined for inputs of any size, such as graphs with different numbers of nodes and point clouds with varying numbers of points. The universality properties of such any-dimensional models remain poorly understood, as universality is traditionally studied for models accepting inputs of a fixed size, defined on a compact subset of their domain. In sharp contrast, any-dimensional models can be viewed as sequences of functions defined on growing-sized inputs, and it is not clear in which sense they can be universal. We develop a systematic approach to establish any-dimensional universality by identifying any-dimensional functions with a unique function that takes inputs in a suitable infinite-dimensional limit space containing inputs of all finite sizes, as well as their limits. Using the symmetries of these inputs and relations between inputs of different sizes, we show that this limit space admits a natural topology with rich families of compact sets on which any-dimensional universality can be established. We illustrate our approach by showing that several existing architectures fail to be universal, and we propose simple modifications that restore universality.

Applications · Robotics

Abdul Monaf Chowdhury, Akm Moshiur Rahman Mazumder, Safaeid Arib, Rabeya Akter

Robotic manipulation benefits from foundation models that describe goals, but today's agents still lack a principled way to learn from their own mistakes. We ask whether natural language can serve as feedback, an error-reasoning signal that helps embodied agents diagnose what went wrong and correct course. We introduce LAGEA (Language Guided Embodied Agents), a framework that turns episodic, schema-constrained reflections from a vision language model (VLM) into temporally grounded guidance for reinforcement learning. LAGEA summarizes each attempt in concise language, localizes the decisive moments in the trajectory, aligns feedback with visual state in a shared representation, and converts goal progress and feedback agreement into bounded, step-wise shaping rewardswhose influence is modulated by an adaptive, failure-aware coefficient. This design yields dense signals early when exploration needs direction and gracefully recedes as competence grows. On the Meta-World MT10 and Robotic Fetch embodied manipulation benchmarks, LAGEA improves average success over the state-of-the-art (SOTA) methods by 9.0% on random goals, 5.3% on fixed goals, and 17% on fetch tasks, while converging faster. These results support our hypothesis: language, when structured and grounded in time, is an effective mechanism for teaching robots to self-reflect on mistakes and make better choices. Code will be released soon.

Deep Learning · Large Language Models

Ahsan Bilal, Muhammad Ahmed Mohsin, Muhammad Umer, Ali Subhan, Hassan Rizwan, Ayesha Mohsin, Dean Hougen

Test-time compute scaling allocates inference computation uniformly, uses fixed sampling strategies, and applies verification only for reranking. In contrast, we propose a verifier-guided adaptive framework treating reasoning as iterative trajectory generation and selection. For each problem, the agent runs multiple inference iterations. In each iteration, it optionally produces a high-level plan, selects a set of reasoning tools and a compute strategy together with an exploration parameter, and then generates a candidate reasoning trajectory. A process reward model (PRM) serves as a unified control signal: within each iteration, step-level PRM scores are aggregated to guide pruning and expansion during generation, and across iterations, aggregated trajectory rewards are used to select the final response. Across datasets, our dynamic, PRM-guided approach consistently outperforms direct test-time scaling, yielding large gains on MATH-500 and several-fold improvements on harder benchmarks such as AIME24 and AMO-Bench. We characterize efficiency using theoretical FLOPs and a compute intensity metric penalizing wasted generation and tool overhead, demonstrating that verification-guided allocation concentrates computation on high-utility reasoning paths.

Reinforcement Learning · Planning

Yunxiang LI, Mark Schmidt, Reza Babanezhad, Sharan Vaswani

Temporal difference (TD) learning is a fundamental algorithm for estimating value functions in reinforcement learning. Recent finite-time analyses of TD with linear function approximation quantify its theoretical convergence rate. However, they often require setting the algorithm parameters using problem-dependent quantities that are difficult to estimate in practice --- such as the minimum eigenvalue of the feature covariance ($\omega$) or the mixing time of the underlying Markov chain ($\tau_\text{mix}$). In addition, some analyses rely on nonstandard and impractical modifications, exacerbating the gap between theory and practice. To address these limitations, we use an exponential step-size schedule with the standard TD(0) algorithm. We analyze the resulting method under two sampling regimes: independent and identically distributed (i.i.d.) sampling from the stationary distribution, and the more practical Markovian sampling along a single trajectory. In the i.i.d. setting, the proposed algorithm does not require the knowledge of problem-dependent quantities such as $\omega$, and attains the optimal bias-variance trade-off for the last iterate. In the Markovian setting, we propose a regularized TD(0) algorithm with an exponential step-size schedule. The resulting algorithm achieves a comparable convergence rate to prior works, without requiring projections, iterate averaging, or knowledge of $\tau_\text{mix}$ or $\omega$.

Deep Learning · Graph Neural Networks

David R Johnson, Alexander Sietsema, Rishabh Anand, Deanna Needell, Smita Krishnaswamy, Michael Perlmutter

We introduce vector diffusion wavelets (VDWs), a novel family of wavelets inspired by the vector diffusion maps algorithm that was introduced to analyze data lying in the tangent bundle of a Riemannian manifold. We show that these wavelets may be effectively incorporated into a family of geometric graph neural networks, which we refer to as VDW-GNNs. We demonstrate that such networks are effective on synthetic point cloud data, as well as on real-world data derived from wind-field measurements and neural activity data. Theoretically, we prove that these new wavelets have desirable frame theoretic properties, similar to traditional diffusion wavelets. Additionally, we prove that these wavelets have desirable symmetries with respect to rotations and translations.

Social Aspects · Accountability, Transparency, and Interpretability

Raghu Arghal, Fade Chen, Niall Dalton, Evgenii Kortukov, Calum McNamara, Angelos Nalmpantis, Moksh Nirvaan, Gabriele Sarti, Mario Giulianelli

Understanding an agent's goals helps explain and predict its behaviour, yet there is no established methodology for reliably attributing goals to agentic systems. We propose a framework for evaluating goal-directedness that integrates behavioural evaluation with interpretability-based analyses of models' internal representations. As a case study, we examine an LLM agent navigating a 2D grid world toward a goal state. Behaviourally, we evaluate the agent against an optimal policy across varying grid sizes, obstacle densities, and goal structures, finding that performance scales with task difficulty while remaining robust to difficulty-preserving transformations and complex goal structures. We then use probing methods to decode the agent's internal representations of the environment state and its multi-step action plans. We find that the LLM agent non-linearly encodes a coarse spatial map of the environment, preserving approximate task-relevant cues about its position and the goal location; that its actions are broadly consistent with these internal representations; and that reasoning reorganises them, shifting from broader environment structural cues toward information supporting immediate action selection. Our findings support the view that introspective examination is required beyond behavioural evaluations to characterise how agents represent and pursue their objectives.

Theory · Probabilistic Methods

Andrej Bogdanov, Alon Rosen, Neekon Vafa

We show how an adversarial model trainer can plant backdoors in a large class of deep, feedforward neural networks. These backdoors are statistically undetectable in the white-box setting, meaning that the backdoored and honestly trained models are close in total variation distance, even given the full descriptions of the models (e.g., all of the weights). The backdoor provides access to invariance-based adversarial examples for every input, mapping distant inputs to unusually close outputs. However, without the backdoor, it is provably impossible (under standard cryptographic assumptions) to generate any such adversarial examples in polynomial time. Our theoretical and preliminary empirical findings demonstrate a fundamental power asymmetry between model trainers and model users.

Applications · Energy

Chao Shen, Zihan Guo, Xu Wan, Zhenghao Yang, Yifan Zhang, Wenqi Huang, Jie Song, Zongyan Zhang, Mingyang Sun

Growing renewable penetration introduces substantial uncertainty into power system operations, necessitating frequent adaptation of dispatch objectives and constraints and challenging expertise-intensive, near-real-time modeling workflows. Large Language Models (LLMs) provide a promising avenue for automating this process by translating natural-language (NL) operational requirements into executable optimization models via semantic reasoning and code synthesis. Yet existing LLM datasets and benchmarks for optimization modeling primarily target coarse-grained cross-domain generalization, offering limited, rigorous evaluation in powersystem settings, particularly for Optimal Power Flow (OPF). We therefore introduce ProOPFD and ProOPF-B, a dataset and benchmark for professional-grade OPF modeling: ProOPF-D contains 12K instances pairing NL requests with parameter adjustments and structural extensions to a canonical OPF, together with executable implementations; ProOPF-B provides 121 expertannotated test cases with ground-truth code, enabling end-to-end evaluation under both concrete and abstract OPF modeling regimes.

Deep Learning · Foundation Models

Xueying Ding, Haomin Wen, Simon Klüttermann, Leman Akoglu

Outlier detection (OD) is widely used in practice; but its effective deployment on new tasks is hindered by lack of labeled outliers, which makes algorithm and hyperparameter selection notoriously hard. Foundation models (FMs) have transformed ML, and OD is no exception: Shen et al. (2025) introduced FOMO-0D, the first FM for OD, achieving remarkable performance against numerous baselines. This work introduces OUTFORMER, which advances FOMO-0D with (1) a mixture of synthetic priors and (2) self-evolving curriculum training. OUTFORMER is pretrained solely on synthetic labeled datasets and infers test labels of a new task by using its training data as in-context input. Inference is fast and zero-shot, requiring merely forward pass and no labeled outliers. Thanks to in-context learning, it requires zero additional work—no OD model training or bespoke model selection—enabling truly plug-and-play deployment. OUTFORMER achieves state-of-the-art performance on the prominent ADBench, as well as two new large-scale OD benchmarks that we introduce, comprising over 1,500 datasets, while maintaining speedy inference.

Deep Learning · Large Language Models

Jie He, Chao Chen, Weidong Bao, Zhengyi Zhong, Shuai Zhang, Ji Wang

Task-vector–based model merging enables low-cost, training-free multi-task learning for large language models, but suffers from severe performance degradation due to task conflict. Prior mitigation strategies largely rely on validation data for costly hyperparameter tuning, limiting both interpretability and practicality. We therefore propose OPIC, an evolutionary optimization–based model merging framework. Our preliminary experiments reveal that the degradation of In-Context Learning (ICL) capabilities is a primary driver of task conflict. Motivated by this insight, we formulate model merging as an optimization problem with ICL preservation as the objective. OPIC introduces a hierarchical refinement operators and optimizes it using self-generated data, effectively eliminating the reliance on external validation sets. Experimental results demonstrate that OPIC achieves an average performance retention of 80.73%, outperforming SOTA methods and improving by up to 11.1% over recent validation-free approaches. In addition, OPIC is compatible with existing merging pipelines, offering a new alternative solution for deploying without validation dependencies. Code is available at: https://anonymous.4open.science/r/OPIC-CFFE.

General Machine Learning · Evaluation

Priyaranjan Pattnayak, Ishan Banerjee

Large language models (LLMs) are increasingly used as assistive interfaces for users who cannot reliably produce clean text due to accessibility constraints, yet existing evaluations assume iterative input repair and focus on task accuracy or generic noise robustness. We introduce Assistive Prompt Mediation (APM), a theory-grounded evaluation paradigm that reframes assistance as a constrained mediation problem: recovering latent user intent from accessibility-impaired input without clarification, while minimizing cognitive burden and hallucination risk. APM decomposes assistive quality along these axes and is instantiated across 8 languages, 4 accessibility-driven noise classes, and 10 frontier LLMs, with impairment severity yielding accessibility sensitivity curves. Results show that apparent robustness often masks trade-offs—high intent preservation frequently coincides with increased burden or hallucinated mediation, hallucination rates vary by more than $2\times$ across noise types, and assistive decisions exhibit bounded entropy ($<0.81$ normalized), indicating systematic rather than unstable behavior. These findings demonstrate that standard robustness metrics substantially overestimate assistive reliability and motivate evaluating LLMs as constrained mediators under accessibility-driven input degradation.

Applications · Computer Vision

Yuan Zeng, Yujia Shi, Tiao Tan, Xingting Li, Yaqi Qin, Zongqing Lu, Wenming Yang, Jing-Hao Xue, Qingmin Liao

Estimating full-hand grasp pressure from egocentric video is critical for immersive VR and robotic manipulation, yet dense tactile sensing often relies on intrusive hardware. Existing vision-based methods predominantly rely on planar surfaces or fingertip contacts, failing to generalize to complex 3D object interactions. Therefore, we introduce EgoTactile, a benchmark pairing egocentric video with full-hand pressure supervision for diverse everyday objects, incorporating a bare-hand transfer subset to enable generalization to natural scenarios. Leveraging this benchmark, we first establish EgoPressureFormer as a discriminative baseline. Beyond this, to explicitly address the uncertainty in partial observations, we propose EgoPressureDiff, a conditional diffusion framework that adapts a large-scale pre-trained video diffusion backbone. By combining rich world knowledge priors with a Physically-Informed Feature Rectification layer to inject semantic constraints, our approach effectively hallucinates plausible contact patterns and resolves visual-physical ambiguities. Extensive experiments demonstrate that our method achieves superior performance on the benchmark and robust transferability to in-the-wild scenarios. Our project page is at https://egotactile.github.io/.