# Research Papers — 2026-05 · bundle page 190 of 326

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### PVRF: All-in-one Adverse Weather Removal via Prior-modulated and Velocity-constrained Rectified Flow

Authors: Wei Dong, Han Zhou, Terry Ji, Guanhua Zhao, Shahab Asoodeh, Yulun Zhang, Guangtao Zhai, Jun Chen, Xiaohong Liu
Published: 2026-05-13
Categories: cs.CV
arXiv: https://arxiv.org/abs/2605.14045v1

Adverse weather removal (AWR) in real-world images remains challenging due to heterogeneous and unseen degradations, while distortion-driven training often yields overly smooth results. We propose PVRF, a unified framework that integrates zero-shot soft weather perceptions with velocity-constrained rectified-flow refinement. PVRF introduces an AWR-specific question answering module (AWR-QA) that uses frozen vision--language models (VLMs) to estimate soft probabilities of weather types and low-level attribute scores. These perceptions condition restoration networks via attribute-modulated normalization (AMN) and weather-weighted adapters (WWA), producing an anchor estimate for refinement. We then learn a terminal-consistent residual rectified flow with perception-adaptive source perturbation and a terminal-consistent velocity parameterization to stabilize learning near the terminal regime. Extensive experiments show that PVRF improves both fidelity and perceptual quality over state-of-the-art baselines, with strong cross-dataset generalization on single and combined degradations. Code will be released at https://github.com/dongw22/PVRF.

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### Wahkon: A Statistically Principled Deep RKHS Superposition Network

Authors: Yongkai Chen, Wenxuan Zhong, Ping Ma
Published: 2026-05-13
Categories: stat.ME, cs.LG
arXiv: https://arxiv.org/abs/2605.14041v1

Deep learning excels at prediction but often lacks finite-sample guarantees and calibrated uncertainty; RKHS (Reproducing Kernel Hilbert Space)-based methods provide those guarantees but struggle to adapt in high dimensions. We propose Wahkon, a deep RKHS superposition network that unifies Kolmogorov's superposition principle with RKHS regularization in the smoothing-spline tradition of Wahba. This yields a finite-dimensional deep representer theorem that makes training tractable and provides explicit layerwise complexity control. We show the penalized estimator is exactly the MAP (maximum a posteriori) estimate under a hierarchical Gaussian-process prior, extending the spline/GP duality to deep compositions. Using metric-entropy arguments, we establish minimax-optimal convergence rates under mild smoothness and clarify how depth and width trade off with regularity. Empirically, Wahkon outperforms multilayer perceptrons, Neural Tangent Kernels, and Kolmogorov--Arnold Networks across simulation benchmarks and a single-cell CITE-seq study. By unifying Kolmogorov's superposition principle with RKHS regularization, Wahkon delivers accuracy, interpretability, and statistical rigor in a single framework.

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### Physics-R1: An Audited Olympiad Corpus and Released Verifiers for Visual Physics Reasoning

Authors: Shan Yang
Published: 2026-05-13
Categories: cs.CL
arXiv: https://arxiv.org/abs/2605.14040v2

Trackable improvement in multimodal physics reasoning rests on a training-and-evaluation system that is itself rarely verified: the corpora a model trains on, the reward it is optimized against, and the benchmarks and judges that score it. We audit this system end to end and find that standard construction practices systematically distort measurement: contamination slips past n-gram deduplication, translation degrades problems, saturated multiple-choice formats overstate capability, partial-credit training rewards are easier to exploit than to earn, and open-ended grading silently depends on the choice of judge. Left unverified, these distortions inflate reported progress and leak test knowledge into training. We answer with a released verifier system: a three-stage contamination audit that certifies the train/test boundary behind an audited multimodal training corpus and a held-out olympiad benchmark; a binary answer verifier that supplies the reinforcement-learning training reward; and an answer-judging harness that brackets every open-ended score between a deterministic strict layer and a large-language-model liberal layer. All per-record verdicts are released and cross-checked against an independent open-weight judge, whose substitution shifts absolute scores but preserves the sign of every base-to-trained lift. Training against the binary answer verifier confirms the certified corpus supports training: a reference recipe lifts an 8B open-source base by 18.3 points on the held-out benchmark across three seeds. The simple binary reward also beats a dense partial-credit variant on three of four open-ended benchmarks, tying the fourth. All verifiers, verdicts, and datasets are public.

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### Physics-R1: An Audited Olympiad Corpus and Recipe for Visual Physics Reasoning

Authors: Shan Yang
Published: 2026-05-13
Categories: cs.CL
arXiv: https://arxiv.org/abs/2605.14040v1

We audit the multimodal-physics evaluation pipeline end-to-end and document three undetected construction practices that distort how the field measures vision-language reasoning: train-eval contamination, translation drift, and MCQ saturation. (1) Public training pools (UGPhysics-Train, SciInstruct, MMK12) pass single-stage 5-gram-Jaccard audits with zero hits across all six public physics evals; a three-stage audit (Jaccard -&gt; mxbai-embed-large cosine -&gt; Haiku-4.5 LLM-judge) surfaces 134 near-duplicates and 4,846 paraphrase candidates in SciInstruct alone. (2) A 17-pp Sonnet 4.5 delta on 59 paired Estonian-English olympiad problems (30.5% vs. 13.6%; sign test p=0.011, McNemar p=0.021, paired bootstrap 95% CI (+5.1, +28.9) pp). (3) A 46-pp format-and-novelty gradient on identical Sonnet weights between MCQ (79.7% on PhyX) and open-ended olympiad evaluation (33.4% on PhysOlym-A). We release four artifacts addressing these gaps: PhysCorp-A (6,432-record three-stage-audited multimodal corpus), PhysR1Corp (2,268-record closed-form RL pool), PhysOlym-A (500-problem, 99.8% novel-source held-out olympiad eval with native difficulty labels and an EN/ET bilingual subset), and Physics-R1, a reference GSPO+DAPO recipe cold-started from Qwen3-VL-8B-Thinking. Across 3 seeds, Physics-R1 lifts the audited corpus over the 8B base by +18.3 pp on PhysOlym-A liberal (8.0 -&gt; 26.3 +/- 1.7; 7.1 pp behind Sonnet 4.5), +15.7 pp on PhysReason (23.9 -&gt; 39.6 +/- 6.4; ahead of Qwen3-VL-32B and Gemini 2.5 Pro), +6.9 pp on OlympiadBench-Physics (46.2 +/- 1.5), and +4.1 pp on PhyX MCQ (77.8 +/- 0.3).

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### Model-Adaptive Tool Necessity Reveals the Knowing-Doing Gap in LLM Tool Use

Authors: Yize Cheng, Chenrui Fan, Mahdi JafariRaviz, Keivan Rezaei, Soheil Feizi
Published: 2026-05-13
Categories: cs.AI
arXiv: https://arxiv.org/abs/2605.14038v2

Large language models (LLMs) increasingly act as autonomous agents that must decide when to answer directly vs. when to invoke external tools. Prior work studying adaptive tool use has largely treated tool necessity as a model-agnostic property, annotated by human or LLM judge, and mostly cover cases where the answer is obvious (e.g., fetching the weather vs. paraphrasing text). However, tool necessity in the wild is more nuanced due to the divergence of capability boundaries across models: a problem solvable by a strong model on its own may still require tools for a weaker one. In this work, we introduce a model-adaptive definition of tool-necessity, grounded in each model's empirical performance. Following this definition, we compare the necessity against observed tool-call behavior across four models on arithmetic and factual QA dataset, and find substantial mismatches of 26.5-54.0% and 30.8-41.8%, respectively. To diagnose the failure, we decompose tool use into two stages: an internal cognition stage that reflects whether a model believes a tool is necessary, and an execution stage that determines whether the model actually makes a tool-call action. By probing the LLM hidden states, we find that both signals are often linearly decodable, yet their probe directions become nearly orthogonal in the late-layer, last-token regime that drives the next-token action. By tracing the trajectory of samples in the two-stage process, we further discover that the majority of mismatch is concentrated in the cognition-to-action transition, not in cognition itself. These results reveal a knowing-doing gap in LLM tool-use: improving tool-use reliability requires not only better recognition of when tools are needed, but also better translation of that recognition into action.

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### Self-Pruned Key-Value Attention: Learning When to Write by Predicting Future Utility

Authors: Gergely Szilvasy, Manuel Faysse, Maria Lomeli, Matthijs Douze, Pierre-Emmanuel Mazaré, Loïc Cabannes, Wen-tau Yih, Hervé Jégou
Published: 2026-05-13
Categories: cs.LG, cs.CL
arXiv: https://arxiv.org/abs/2605.14037v1

Under modern test-time compute and agentic paradigms, language models process ever-longer sequences. Efficient text generation with transformer architectures is increasingly constrained by the Key-Value cache memory footprint and bandwidth. To address this limitation, we introduce Self-Pruned Key-Value Attention (SP-KV), a mechanism designed to predict future KV utility in order to reduce the size of the long-term KV cache. This strategy operates at a fine granularity: a lightweight utility predictor scores each key-value pair, and while recent KVs are always available via a local window, older pairs are written in the cache and used in global attention only if their predicted utility surpasses a given threshold. The LLM and the utility predictor are trained jointly end-to-end exclusively through next-token prediction loss, and are adapted from pretrained LLM checkpoints. Rather than enforcing a fixed compression ratio, SP-KV performs dynamic sparsification: the mechanism adapts to the input and typically reduces the KV cache size by a factor of $3$ to $10\times$, longer sequences often being more compressible. This leads to vast improvements in memory usage and decoding speed, with little to no degradation of validation loss nor performance on a broad set of downstream tasks. Beyond serving as an effective KV-cache reduction mechanism, our method reveals structured layer- and head-specific sparsity patterns that we can use to guide the design of hybrid local-global attention architectures.

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### Enhanced and Efficient Reasoning in Large Learning Models

Authors: Leslie G. Valiant
Published: 2026-05-13
Categories: cs.AI, cs.CC, cs.CL, cs.LG
arXiv: https://arxiv.org/abs/2605.14036v1

In current Large Language Models we can trust the production of smoothly flowing prose on the basis of the principles of machine learning. However, there is no comparably principled basis to justify trust in the content of the text produced. It appears to be conventional wisdom that addressing this issue by adding more principled reasoning is not computationally affordable. Here we propose a principled method of reasoning that is efficient enough to be practical for large language models. Further, the method allows the retention of much of the currently used software and hardware base. Our method for improving the functioning of large language models consists of a first stage of preprocessing that recodes the data to a Unary Relational Integracode that is more explicit about the relationships among the objects described in the text, followed as a second stage by a standard but possibly streamlined machine learning process that then also learns to predict these relationships. The method may be viewed as realizing a world model and applying beyond natural language, to vision and actions, for example, where the multiple properties of an object referred to in an input are brought together explicitly, rather than remaining distributed in the various references to it in the input. We articulate its advantages in terms of Robust Logic, a system for performing principled chaining on learned, and hence uncertain, information. We show that this recoding has the surprising and fortuitous property that, while succinct, it makes the task of learning a core subset of relational rules that hold in the world described in the training data polynomial time learnable in a defined sense, the polynomial depending on the complexity of the rule. This gives support for sound reasoning within each single call of the learned classifier as well as between multiple calls.

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### From Descriptive to Prescriptive: Uncover the Social Value Alignment of LLM-based Agents

Authors: Jinxian Qu, Qingqing Gu, Teng Chen, Luo Ji
Published: 2026-05-13
Categories: cs.AI, cs.CL, cs.CY
arXiv: https://arxiv.org/abs/2605.14034v1

Wide applications of LLM-based agents require strong alignment with human social values. However, current works still exhibit deficiencies in self-cognition and dilemma decision, as well as self-emotions. To remedy this, we propose a novel value-based framework that employs GraphRAG to convert principles into value-based instructions and steer the agent to behave as expected by retrieving the suitable instruction upon a specific conversation context. To evaluate the ratio of expected behaviors, we define the expected behaviors from two famous theories, Maslow's Hierarchy of Needs and Plutchik's Wheel of Emotion. By experimenting with our method on the benchmark of DAILYDILEMMAS, our method exhibits significant performance gains compared to prompt-based baselines, including ECoT, Plan-and-Solve, and Metacognitive prompting. Our method provides a basis for the emergence of self-emotion in AI systems.

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### Sheaf-Theoretic Transport and Obstruction for Detecting Scientific Theory Shift in AI Agents

Authors: David N. Olivieri, Roque J. Hernández
Published: 2026-05-13
Categories: cs.AI, cs.LG
arXiv: https://arxiv.org/abs/2605.14033v1

Scientific theory shift in AI agents requires more than fitting equations to data. An artificial scientific agent must detect whether an existing representational framework remains transportable into a new regime, or whether its language has become locally-to-globally obstructed and must be extended. This paper develops a finite sheaf-theoretic framework for detecting theory-shift candidates through transport and obstruction. Contexts are organized as a local-to-global structure in which source, overlap, target, and validation charts are fitted, restricted, and tested for gluing. Obstruction measures failure of coherence through residual fit, overlap incompatibility, constraint violation, limiting-relation failure, and representational cost. We evaluate the framework on a controlled transition-card benchmark designed to separate deformation within a source language from extension of that language. The main result is direct obstruction ranking: the intended deformation or extension is usually the lowest-obstruction candidate, and transition type is separated in the benchmark. A constellation kernel over the same signatures is included only as a secondary representational-similarity probe. The aim is not to reconstruct historical paradigm shifts or solve open-ended autonomous theory invention, but to isolate a finite diagnostic subproblem for AI agents: detecting when representational transport fails and extension becomes the coherent next move.

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### Masked Autoencoders with Limited Data: Does It Work? A Fine-Grained Bioacoustics Case Study

Authors: Wuao Liu, Mustafa Chasmai, Subhransu Maji, Grant Van Horn
Published: 2026-05-13
Categories: cs.SD, cs.CV, cs.LG
arXiv: https://arxiv.org/abs/2605.14031v1

Bioacoustic recognition requires fine-grained acoustic understanding to distinguish similar-sounding species. However, many large-scale data repositories such as iNaturalist are weakly annotated, often with only a single positive species label per recording, making supervised learning particularly challenging. Inspired by advances in computer vision, recent approaches have shifted toward self-supervised learning to capture the underlying structure of audio without relying on exhaustive annotations. In particular, masked autoencoders (MAE) have shown strong transferability on massive audio corpora, yet their effectiveness in more modest bioacoustic settings remains underexplored. In this work, we conduct a systematic study of MAE pretraining for species classification on iNatSounds, analyzing the impacts of pretraining data scale, domain specificity, data curation, and transfer strategies. Consistent with prior work, we find that models pretrained on diverse general audio data achieve the best transfer performance on iNatSounds. Contrary to observations from large-scale audio benchmarks, we find that (1) additional masked reconstruction pretraining on domain-specific data provides limited benefits and may even degrade performance relative to off-the-shelf models, and (2) selective data filtering offers a negligible advantage when the overall data scale is limited. Our results indicate that, in moderate-sized fine-grained bioacoustic settings, pretraining scale dominates objective design. These findings further clarify when MAE-based pretraining is effective and provide practical guidance for model selection under limited supervision.

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### Unified Pix Token And Word Token Generative Language Model

Authors: Haun Leung, ZiNan Wang
Published: 2026-05-13
Categories: cs.CV
arXiv: https://arxiv.org/abs/2605.14028v2

Since the emergence of Vision Transformer (ViT), it has been widely used in generative language model and generative visual model. Especially in the current state-of-art open source multimodal models, ViT obtained by CLIP or SigLIP method serves as the vision encoder backbone to help them acquire visual understanding capabilities. But this method leads to limitations in visual understanding for details, such as difficulty in recognizing small text or numbers in images. To address these issues, we propose a new model to unify pix token and word token into the generative language model. The new model also features with each pix of image having its own token embedding, color folding, global conditional attention approximation and image unsupervised pretraining. We conducted image unsupervised pretraining experiments using our new model to explore its potential. The experimental results show that it has good performance even in small model and with limited training data. We believe our model also conforms to the scaling law, as long as model parameters and training data increased, its performance will continue to improve.

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### R2R2: Robust Representation for Intensive Experience Reuse via Redundancy Reduction in Self-Predictive Learning

Authors: Sanghyeob Song, Donghyeok Lee, Jinsik Kim, Sungroh Yoon
Published: 2026-05-13
Categories: cs.LG, cs.AI
arXiv: https://arxiv.org/abs/2605.14026v1

For reinforcement learning in data-scarce domains like real-world robotics, intensive data reuse enhances efficiency but induces overfitting. While prior works focus on critic bias, representation-level instability in Self-Predictive Learning (SPL) under high Update-to-Data (UTD) regimes remains underexplored. To bridge this gap, we propose Robust Representation via Redundancy Reduction (R2R2), a regularization method within SPL. We theoretically identify that standard zero-centering conflicts with SPL's spectral properties and design a non-centered objective accordingly. We verify R2R2 on SPL-native algorithms like TD7. Furthermore, to demonstrate its orthogonality to prior advancements, we extend the state-of-the-art SimbaV2, which originally lacks SPL, by integrating a tailored SPL module, termed SimbaV2-SPL. Experiments across 11 continuous control tasks confirm that R2R2 effectively mitigates overfitting; specifically, at a UTD ratio of 20, it improves TD7 by ~22% and provides additional gains on top of SimbaV2-SPL, which itself establishes a new state-of-the-art. The code can be found at: https://github.com/songsang7/R2R2

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### Do Language Models Align with Brains? Prediction Scores Are Not Enough

Authors: Xiao Jia
Published: 2026-05-13
Categories: q-bio.NC, cs.AI
arXiv: https://arxiv.org/abs/2605.14025v1

Brain-language model comparisons often interpret neural prediction scores as evidence that model representations capture brain-relevant language computation. We asked whether language models align with brains, and whether prediction scores are enough to support that claim, using L-PACT, a source-audited framework that evaluates predictive, relational, mechanism-stripping, and reliability-bounded evidence. Across primary naturalistic language neural datasets and derived language-model representations, L-PACT compared real model features with nuisance baselines and severe controls, tested whether model-to-brain profiles reproduced brain-to-brain patterns, recomputed held-out scores after mechanism stripping, and normalized evidence against brain-brain ceilings. The locked analysis set contains 414 predictive-control rows, 2304 relational profile rows, 4320 mechanism-stripping rows, 420 brain-brain ceiling rows, and 146 integrated decision rows. Assay-sensitivity checks showed that brain-brain reliability, brain-as-model run-to-run relational profiles, independent low-level neural and WAV-derived acoustic-envelope gates, and a deterministic implanted-signal simulation can produce positive evidence when expected. Nevertheless, no real model row passed the predictive, relational, mechanism-stripping, or operational Turing-bounded reliability gates; all 146 integrated rows were control-explained. Less stringent single-criterion rules would have counted raw positive predictive, relational, stripping-delta, and ceiling-normalized effects, but L-PACT downgraded them because controls explained the apparent evidence. In the analyzed derived artifact set, the tested language-model representations do not satisfy L-PACT alignment gates; apparent positives are converted into an auditable control-explained taxonomy rather than treated as structural alignment.

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### Measuring Google AI Overviews: Activation, Source Quality, Claim Fidelity, and Publisher Impact

Authors: Haofei Xu, Umar Iqbal, Jacob M. Montgomery
Published: 2026-05-13
Categories: cs.CY, cs.AI
arXiv: https://arxiv.org/abs/2605.14021v1

Google AI Overviews (AIOs) are arguably the most widely encountered deployment of generative AI, reaching over 2 billion users who may not realize the answers they see are AI-generated. Where search engines have traditionally surfaced ranked sources and left users to evaluate them, AIOs synthesize and deliver a single answer - giving Google unprecedented editorial control over what users read and know. We present a large-scale longitudinal measurement study, issuing 55,393 trending queries across 19 topical categories over a 40-day window (March 13 - April 21, 2026). We report four main findings. First, overall AIO activation is 13.7%, rising to 64.7% for question-form queries, while politically sensitive topics see markedly lower rates. Second, AIO-cited domains are more credible than co-displayed first-page results, yet nearly 30% do not appear in those results at all, indicating a source selection mechanism distinct from Google's ranking algorithm. Third, decomposing responses into 98,020 atomic claims, 11.0% are unsupported by the cited pages - with omission the dominant failure mode - and source quality and claim fidelity are largely independent. Fourth, well over half of AIO-cited pages carry display advertising, meaning publishers lose revenue when AIOs suppress the click-through, even as Google's own sponsored ads continue to appear on the same page. Together, these findings document a rapid transformation of the online information ecosystem whose consequences for epistemic security remain poorly understood.

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### Regret Equals Covariance: A Closed-Form Characterization for Stochastic Optimization

Authors: Irene Aldridge
Published: 2026-05-13
Categories: econ.EM, cs.LG, math.ST, stat.CO
arXiv: https://arxiv.org/abs/2605.14019v2

Quantifying regret typically involves repeatedly re-solving a stochastic optimization problem across simulated scenarios. Such an approach is costly: the cost scales with the number of scenarios and the cost of each solve. We propose that regret can instead be measured using the joint moments of the cost vector $c$ and the optimal decision $π^*(c)$. Working with the optimal concave and Lipschitz under only a feasible region value function $v(c) = \min_{z\in Z} c^\top z$, we show that regret always decomposes as $\mathrm{Regret} = -\mathrm{Cov}(c,π^*(c)) - R(c)$ for a residual $R(c)$. We further show that $R(c)=0$ when $π^*$ is affine in $c$, which holds for unconstrained and equality-constrained (e.g., budget-constrained Markowitz) quadratic programs and many, but not all, linear programs. For all cases, we give a distribution-free bound $\mathrm{Regret} \le D\sqrt{\mathrm{tr}(Σ_c)}$ that depends only on the radius of the feasible region and the cost covariance. We also derive concentration and asymptotic-normality results for the empirical regret, the latter under an explicit and checkable non-degeneracy condition.

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### Regret Equals Covariance: A Closed-Form Characterization for Stochastic Optimization

Authors: Irene Aldridge
Published: 2026-05-13
Categories: econ.EM, cs.LG, math.ST, stat.CO
arXiv: https://arxiv.org/abs/2605.14019v1

Regret is the cost of uncertainty in algorithmic decision-making. Quantifying regret typically requires computationally expensive simulation via Sample Average Approximation (SAA), with complexity $\mathcal{O}(Bn^{2}d^{3})$ in the number of scenarios $B$, variables $n$, and constraints $d$. % This paper proves that expected regret in any stochastic optimization problem admits the exact decomposition % \begin{equation*} \mathrm{Regret}(c) = \mathrm{Cov}(c,\,π^{*}(c)) + R(c), \end{equation*} % where $c$ is the vector of uncertain parameters, $π^{*}(c)$ is the optimal decision, and $R(c)$ is a residual whose magnitude we bound explicitly under Lipschitz, smooth, and strongly convex conditions. % For linear programs and unconstrained quadratic programs, including the classical Markowitz portfolio problem, we prove $R(c)=0$ exactly, so that $\mathrm{Regret}(c) = \mathrm{Cov}(c,π^{*}(c))$ holds without approximation. % When historical cost-decision pairs $\{(c_i, π^*(c_i))\}$ are available, the covariance can be estimated in $\mathcal{O}(nd^{2})$ time, which is orders of magnitude faster than SAA. The estimation is performed by a single pass through the data. % We derive concentration bounds, a central limit theorem, and an asymptotically unbiased residual estimator, and we validate all results on synthetic LP, QP, and integer programming instances and on a rolling-window portfolio experiment using ten years of CRSP equity data.

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### Dywave: Event-Aligned Dynamic Tokenization for Heterogeneous IoT Sensing Signals

Authors: Tomoyoshi Kimura, Denizhan Kara, Jinyang Li, Hongjue Zhao, Yigong Hu, Yizhuo Chen, Xiaomin Ouyang, Shengzhong Liu, Tarek Abdelzaher
Published: 2026-05-13
Categories: cs.LG, cs.AI
arXiv: https://arxiv.org/abs/2605.14014v2

Internet of Things (IoT) systems continuously collect heterogeneous sensing signals from ubiquitous sensors to support intelligent applications such as human activity analysis, emotion monitoring, and environmental perception. These signals are inherently non-stationary and multi-scale, posing unique challenges for standard tokenization techniques. This paper proposes Dywave, a dynamic tokenization framework for IoT sensing signals that constructs compact input representations aligned with intrinsic temporal structures and underlying physical events. Dywave leverages wavelet-based hierarchical decomposition, identifies meaningful temporal boundaries corresponding to underlying semantic events, and adaptively compresses redundant intervals while preserving temporal coherence. Extensive evaluations on five real-world IoT sensing datasets across activity recognition, stress assessment, and nearby object detection demonstrate that Dywave outperforms state-of-the-art methods by up to 12% in accuracy, while improving computational efficiency by reducing input token lengths by up to 75% across mainstream sequence models. Moreover, Dywave exhibits improved robustness to domain shifts and varying sequence lengths.

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### Mistletoe: Stealthy Acceleration-Collapse Attacks on Speculative Decoding

Authors: Shuoyang Sun, Chang Dai, Hao Fang, Kuofeng Gao, Xinhao Zhong, Yi Sun, Fan Mo, Shu-Tao Xia, Bin Chen
Published: 2026-05-13
Categories: cs.CL, cs.LG
arXiv: https://arxiv.org/abs/2605.14005v2

Speculative decoding has become a widely adopted technique for accelerating large language model (LLM) inference by drafting multiple candidate tokens and verifying them with a target model in parallel. Its efficiency, however, critically depends on the average accepted length $τ$, i.e., how many draft tokens survive each verification step. In this work, we identify a new mechanism-level vulnerability in model-based speculative decoding: the drafter is trained to approximate the target model distribution, but this approximation is inevitably imperfect. Such a drafter-target mismatch creates a hidden attack surface where small perturbations can preserve the target model's visible behavior while substantially reducing draft-token acceptability. We propose Mistletoe, a stealthy acceleration-collapse attack against speculative decoding. Mistletoe directly targets the acceptance mechanism of speculative decoding. It jointly optimizes a degradation objective that decreases drafter-target agreement and a semantic-preservation objective that constrains the target model's output distribution. To resolve the conflict between these objectives, we introduce a null-space projection mechanism, where degradation gradients are projected away from the local semantic-preserving direction, suppressing draft acceptance while minimizing semantic drift. Experiments on various speculative decoding systems show that Mistletoe substantially reduces average accepted length $τ$, collapses speedup, and lowers averaged token throughput, while preserving output quality and perplexity. Our work highlights that speculative decoding introduces a mechanism-level attack surface beyond existing output robustness, calling for more robust designs of LLM acceleration systems.

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### Conditional Attribute Estimation with Autoregressive Sequence Models

Authors: Erica Stutz, Giacomo Marino, Daniella Meeker, Qiao Liu, Andrew J. Loza
Published: 2026-05-13
Categories: cs.AI
arXiv: https://arxiv.org/abs/2605.14004v1

Generative models are often trained with a next-token prediction objective, yet many downstream applications require the ability to estimate or control sequence-level properties. Next-token prediction can lead to overfitting of local patterns during training, underfitting of global structure, and requires significant downstream modifications or expensive sampling to guide or predict the global attributes of generated samples at inference time. Here, we introduce Conditional Attribute Transformers, a novel method for jointly estimating the next-token probability and the value of an attribute conditional on each potential next token selection. This framework enables three critical capabilities within a single forward pass, without modification of the input sequence: (1) per-token credit assignment across an entire sequence, by identifying how each token in a sequence is associated with an attribute's value; (2) counterfactual analysis, by quantifying attribute differences conditional on alternative next token choices; (3) steerable generation, by decoding sequences based on a combination of next-token and attribute likelihoods. Our approach achieves state of the art performance on sparse reward tasks, improves next-token prediction at sufficient model sizes, estimates attribute probabilities orders of magnitude faster than sampling, and can guide decoding of autoregressive sequence models on a range of language tasks.

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### PolitNuggets: Benchmarking Agentic Discovery of Long-Tail Political Facts

Authors: Yifei Zhu
Published: 2026-05-13
Categories: cs.AI
arXiv: https://arxiv.org/abs/2605.14002v1

Large Reasoning Models (LRMs) embedded in agentic frameworks have transformed information retrieval from static, long context question answering into open-ended exploration. Yet real world use requires models to discover and synthesize "long-tail" facts from dispersed sources, a capability that remains under-evaluated. We introduce PolitNuggets, a multilingual benchmark for agentic information synthesis via constructing political biographies for 400 global elites, covering over 10000 political facts. We standardize evaluation with an optimized multi agent system and propose FactNet, an evidence conditional protocol that scores discovery, fine-grained accuracy, and efficiency. Across models and settings, we find that current systems often struggle with fine-grained details, and vary substantially in efficiency. Finally, using benchmark diagnostics, we relate agent performance to underlying model capabilities, highlighting the importance of short-context extraction, multilingual robustness, and reliable tool use.

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### Support Before Frequency in Discrete Diffusion

Authors: Adrian Müller, Antoine Gonon, Zebang Shen, Ya-Ping Hsieh, Niao He
Published: 2026-05-13
Categories: cs.LG
arXiv: https://arxiv.org/abs/2605.13999v1

Discrete diffusion models are increasingly competitive for language modeling, yet it remains unclear how their denoising objectives organize learning. Although these objectives target the full data distribution, we show that the exact reverse process induces a hierarchy between coarse support information and finer frequency information. For uniform and absorbing (a.k.a. masking) diffusion, we prove that, in the small-noise regime of the final denoising steps, each single-token reverse edit decomposes into a leading scale, determined by whether it moves toward the data support (e.g., grammatically valid sentences), and a finer coefficient, determining relative probabilities within the same scale. Thus, recovering validity structure only requires learning the correct order of magnitude of reverse probabilities, whereas recovering data frequencies requires coefficient-level estimation. The separation is mechanism-dependent: uniform diffusion exhibits a trichotomy into validity-improving, validity-preserving, and validity-worsening edits, while absorbing diffusion places its leading-order mass on validity-improving moves. Experiments on a masked language diffusion model and synthetic regular-language tasks support these predictions: support-localization emerges earlier than within-support frequency ranking, and the contrast between uniform and absorbing diffusion matches the predicted rate separation. Together, our results suggest that discrete diffusion models learn data support before data frequencies.

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### Synthetic American Option Pricing via Jump-HMM-Driven Heston Implied Volatility

Authors: Julia Sun, Zheyu Jin, Jiawei Zhang, Jeffrey D. Varner
Published: 2026-05-13
Categories: q-fin.CP, cs.LG
arXiv: https://arxiv.org/abs/2605.13998v2

Valuing American options along simulated stock paths requires an implied volatility (IV) for every option on every date. A stock-return model alone does not provide it. We built a simulator that assigned IV to American options on simulated dates for any chosen stock model. We fitted parametric and neural IV surfaces to vendor option quotes for 31 tickers. Each surface predicted IV from moneyness and time to expiration. Stock paths came from a jump hidden Markov model with capped daily returns. Each day, every option's implied variance moved partway toward its surface prediction, following the form of the Heston variance equation. Random shocks tended to raise IV when the stock fell. A binomial tree converted IV into option values and price sensitivities. Neural surfaces fitted by sector or ticker matched the quotes more closely than one parametric surface. Their errors still varied by date and carried into dollar prices. Repricing identical stock paths under five ways of updating IV changed option values before expiration, and the worst simulated short-position losses at a fixed horizon. Payoffs at expiration did not change. In forecasts of later Goldman Sachs and Eli Lilly option prices, stochastic IV did little better than fixed IV. Rerunning the forecasts with the realized stock paths pointed to stock prediction as a major source of option-price error. The hidden Markov model and an adaptive-volatility model predicted stock prices about as accurately as assuming no change, and tuning found no gain from predicting direction. The adaptive-volatility model improved predicted price ranges for Eli Lilly but not Goldman Sachs. The simulator supported reproducible comparisons of IV and stock assumptions but did not forecast better than simpler alternatives. Complete option histories and prices consistent across strikes are needed before simulated prices can replace market data.

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### Synthetic American Option Pricing via Jump-HMM-Driven Heston Implied Volatility

Authors: Julia Sun, Zheyu Jin, Jiawei Zhang, Jeffrey D. Varner
Published: 2026-05-13
Categories: q-fin.CP, cs.LG
arXiv: https://arxiv.org/abs/2605.13998v1

Generating realistic synthetic option prices requires implied volatility as an input, yet implied volatility is itself derived from observed option prices, creating a circular dependency that limits synthetic data for machine-learning and risk-analysis applications. We break this circularity with a pipeline in which implied volatility emerges as an output of a structural model of equity returns. A Jump Hidden Markov Model produces multi-asset price paths with realistic stylized facts and cross-asset tail dependence; a modified Heston variance process, whose mean-reversion target depends on regime state, days to expiration, moneyness, and a market-mood indicator, converts those paths into implied-volatility paths; and a recombining binomial lattice prices American options from the resulting surface. Initializing variance at its mean-reversion target for each strike-expiration pair lets smile, skew, and term structure emerge without external calibration. We calibrate the shape function through a hierarchy spanning a parametric baseline, a globally shared neural surrogate, and a sector-specific neural surrogate fit to a multi-ticker, multi-sector option ladder. A temporal holdout on a multi-day capture isolated scheduled corporate events as the dominant source of test-time generalization error, and calendar-derived earnings-distance and same-sector peer-coupling features recovered the anticipatory portion of that signal. We then apply the framework as a synthetic-data generator on real near-the-money put and call contracts, forward-simulating price paths, and recovering path-conditional implied volatility, finite-difference American Greeks, and terminal short-premium profit and loss from one coherent simulation, and confirm cross-ticker robustness by re-running on a second underlying from a different sector and volatility regime. The framework is released as an open-source Julia package.

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### HodgeCover: Higher-Order Topological Coverage Drives Compression of Sparse Mixture-of-Experts

Authors: Tao Zhong, Dongzhe Zheng, Christine Allen-Blanchette
Published: 2026-05-13
Categories: cs.LG, cs.AI, cs.CL
arXiv: https://arxiv.org/abs/2605.13997v1

Sparse Mixture-of-Experts (MoE) layers route tokens through a handful of experts, and learning-free compression of these layers reduces inference cost without retraining. A subtle obstruction blocks every existing compressor in this family: three experts can each be pairwise compatible yet form an irreducible cycle when merged together, so any score that ranks experts on pairwise signals is structurally blind to which triples are jointly mergeable. We show the obstruction is a precise mathematical object, the harmonic kernel of the simplicial Laplacian on a 2-complex whose vertices are experts, whose edges carry KL merge barriers, and whose faces carry triplet barriers; Hodge-decomposing the edge-barrier signal isolates the kernel exactly. We turn the diagnostic into a selection objective: HodgeCover greedily covers the harmonic-critical edges and triplet-critical triangles, and a hybrid variant of HodgeCover pairs it with off-the-shelf weight pruning on survivors. On three open-weight Sparse MoE backbones under aggressive expert reduction, HodgeCover matches state-of-the-art learning-free baselines on the expert-reduction axis, leads on the aggressive-compression frontier of the hybrid axis, and uniquely balances retained mass across all four Hodge components. These results show that exposing the harmonic kernel of a learned MoE structure changes which compressor wins at the regime that matters most.

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### CineMesh4D: Personalized 4D Whole Heart Reconstruction from Sparse Cine MRI

Authors: Xiaoyue Liu, Xiaohan Yuan, Mark Y Chan, Ching-Hui Sia, Lei Li
Published: 2026-05-13
Categories: cs.CV, cs.AI
arXiv: https://arxiv.org/abs/2605.13994v1

Accurate 3D+t whole-heart mesh reconstruction from cine MRI is a clinically crucial yet technically challenging task. The difficulty of this task arises from two coupled factors: inherently sparse sampling of 3D cardiac anatomy by 2D image slices and the tight coupling between cardiac shape and motion. Current cardiac image-to-mesh approaches typically reconstruct only a subset of cardiac chambers or a single phase of the cardiac cycle. In this work, we propose CineMesh4D, a novel end-to-end 4D (3D+t) pipeline that directly reconstructs patient-specific whole-heart mesh from multi-view 2D cine MRI via cross-domain mapping. Specifically, we introduce a differentiable rendering loss that enables supervision of 3D+t whole-heart mesh from multi-view sparse contours of cine MRI. Furthermore, we develop a dual-context temporal block that fuses global and local cardiac temporal information to capture high-dimensional sequential patterns. In quantitative and qualitative evaluations, CineMesh4D outperforms existing approaches in terms of reconstruction quality and motion consistency, providing a practical pathway for personalized real-time cardiac assessment. The code will be publicly released once the manuscript is accepted.

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### VectraYX-Nano: A 42M-Parameter Spanish Cybersecurity Language Model with Curriculum Learning and Native Tool Use

Authors: Juan S. Santillana
Published: 2026-05-13
Categories: cs.CL
arXiv: https://arxiv.org/abs/2605.13989v3

We present VectraYX-Nano, a 41.95M-parameter decoder-only language model trained from scratch in Spanish for cybersecurity, with a Latin-American regional focus and native tool invocation via the Model Context Protocol (MCP). The model has four contributions. (i) Corpus: VectraYX-Sec-ES, a 170M-token Spanish corpus assembled by an eight-VM distributed pipeline at ~$25 USD of cloud compute and split into three curriculum phases (conversational 42M, cybersecurity 118M, offensive tooling 10M). (ii) Architecture: a 42M Transformer decoder with GQA, QK-Norm, RMSNorm, SwiGLU, RoPE and z-loss, paired with a domain-balanced 16,384-token byte-fallback BPE. (iii) Curriculum with replay across the three phases yields a monotonic loss descent (9.80 -&gt; 3.17 -&gt; 3.00 -&gt; 2.16); after SFT (loss 1.74) the v2 bootstrap-ablation reference attains a conversational gate of 0.775 +/- 0.043 on B5 over N=4 seeds, and a controlled Phase-2 replay sweep over {0,5,10,25,50}% saturates B5 at &gt;=25% replay. (iv) Two empirical findings, both N=4. A controlled bootstrap-corpus ablation across v2 (OpenSubs), v4 (mC4-ES), and v6 (60/25/15 OpenSubs/mC4/Wiki) exposes a loss-versus-register inversion: lower-perplexity bootstraps yield measurably worse conversational behavior (v2 &gt; v4 &gt; v6 on B5 at every paired seed). The B4 (tool-selection) floor of 0.000 is a corpus-density artifact, not a capacity gate: rebalancing the SFT mixture to tool-use ratio 1:21 yields VectraYX-Nano v7, the released headline configuration, reaching B4 = 0.230 +/- 0.052 at 42M while retaining B1 = 0.332 +/- 0.005 and B5 = 0.725 +/- 0.130; a LoRA replication on a 260M from-scratch mid-tier reaches 0.445 +/- 0.201. The released GGUF is 96 MB in F16, runs sub-second TTFT on commodity hardware under llama.cpp, and is, to our knowledge, the first published Spanish-native cybersecurity LLM with end-to-end MCP integration.

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### Neural Fields for NV-Center Inverse Sensing

Authors: Zhixuan Zhao, Tao Zhong, Yixun Hu, Nathalie P. de Leon, Christine Allen-Blanchette
Published: 2026-05-13
Categories: cs.LG, quant-ph
arXiv: https://arxiv.org/abs/2605.13988v1

Inverse problems in scientific sensing are often solved with either hand-designed regularizers or supervised networks trained on simulated labels, yet both can fail when the forward model is nonlinear, spectrally coupled, and physically delicate. We study this issue for noise sensing based on nitrogen-vacancy (NV) centers in diamond, where a quantum sensor measures magnetic-noise spectra generated by sparse spin sources. We show that replacing a common scalar/coherent forward approximation with a tensor power-summed dipolar operator changes the inverse landscape and exposes a center-collapse failure mode in free-density optimization. We propose NeTMY, an amortization-free coordinate neural field coupled to the differentiable NV forward model, with annealed positional encoding, multiscale optimization, sparsity/gating, and spectrum-fidelity losses. Across sparse synthetic reconstructions generated by the corrected operator, NeTMY achieves the best localization and distributional metrics in the tested benchmark. Mechanism experiments show that NeTMY does not directly execute the raw density-space gradient; its parameterization smooths and redistributes updates, mitigating the center-collapse pathology. These results position NV quantum sensing as a useful testbed for physics-faithful neural inverse problems.

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### TabPFN-3: Technical Report

Authors: Léo Grinsztajn, Klemens Flöge, Oscar Key, Felix Birkel, Philipp Jund, Brendan Roof, Mihir Manium, Shi Bin Hoo, Magnus Bühler, Anurag Garg, Dominik Safaric, Jake Robertson et al.
Published: 2026-05-13
Categories: cs.LG, stat.ML
arXiv: https://arxiv.org/abs/2605.13986v2

Tabular data underpins most high-value prediction problems in science and industry, and TabPFN has driven the foundation model revolution for this modality. Designed with feedback from our users, TabPFN-3 builds on this foundation to scale state-of-the-art performance to datasets with 1M training rows and substantially reduce training and inference time. Pretrained exclusively on synthetic data from our prior, TabPFN-3 dramatically pushes the frontier of tabular prediction and brings substantial gains on time series, relational, and tabular-text data. On the standard tabular benchmark TabArena, a forward pass of TabPFN-3 outperforms all other models, including tuned and ensembled baselines, by a significant margin, and pareto-dominates the speed/performance frontier. On more diverse datasets, TabPFN-3 ranks first on datasets with many classes, and beats 8-hour-tuned gradient-boosted-tree baselines on datasets up to 1M training rows and 200 features. TabPFN-3 introduces test-time compute scaling to tabular foundation models. Our API offering TabPFN-3-Plus (Thinking) exploits this to beat all non-TabPFN models by over 200 Elo on TabArena, rising to 420 Elo on the largest data subset, and outperforms AutoGluon 1.5 extreme while being 10x faster, without using LLMs, real data, internet search or any other model besides TabPFN. TabPFN-3 extends the capabilities of our models, enabling SOTA prediction on relational data (new SOTA foundation model on RelBenchV1) and tabular-text data (SOTA on TabSTAR via TabPFN-3-Plus); and improves existing integrations: a specialized checkpoint, TabPFN-TS-3, ranks 2nd on the time-series benchmark fev-bench, and SHAP-value computation is up to 120x faster. TabPFN-3 achieves this performance while being up to 20x faster than TabPFN-2.5. In addition, a reduced KV cache and row-chunking scale to 1M rows on one H100 with fast inference speed.

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### Towards Resource-Efficient LLMs: End-to-End Energy Accounting of Distillation Pipelines

Authors: Katherine Lambert, Sasha Luccioni
Published: 2026-05-13
Categories: cs.LG, cs.AI
arXiv: https://arxiv.org/abs/2605.13981v1

The rise in deployment of large language models has driven a surge in GPU demand and datacenter scaling, raising concerns about electricity use, grid stress, and the impacts of modern AI workloads. Distillation is often promoted as one of the most effective paths to obtain cheaper, more efficient models, yet these claims rarely account for the full end-to-end energy and resource costs, including crucial teacher-side workloads such as data generation, logit caching, and evaluation. We present a comprehensive energy accounting framework that measures the complete computational cost of distillation pipelines via detailed stage-wise tracking of GPU device power consumption. In our experiments, we separate and log empirical energy use across distinct phases and systematically measure the energy and emissions of two common distillation methods: the classic logit-based knowledge distillation and synthetic-data supervised fine-tuning, constructing energy-quality Pareto frontiers that expose the previously ignored costs. From these measurements and analyses, we derive practical design rules for selecting distillation methods and hyperparameters under energy and budget constraints, and release an open-source measurement harness and accounting protocol to provide a standardized foundation for comparable, reproducible distillation research, explicitly accountable for complete pipeline energy impact.

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### Winning Lottery Tickets in Neural Networks via a Quantum-Inspired Classical Algorithm

Authors: Natsuto Isogai, Hayata Yamasaki, Sho Sonoda, Mio Murao
Published: 2026-05-13
Categories: quant-ph, cs.LG, stat.ML
arXiv: https://arxiv.org/abs/2605.13979v1

Quantum machine learning (QML) aims to accelerate machine learning tasks by exploiting quantum computation. Previous work studied a QML algorithm for selecting sparse subnetworks from large shallow neural networks. Instead of directly solving an optimization problem over a large-scale network, this algorithm constructs a sparse subnetwork by sampling hidden nodes from an optimized probability distribution defined using the ridgelet transform. The quantum algorithm performs this sampling in time $O(D)$ in the data dimension $D$, whereas a naive classical implementation relies on handling exponentially many candidate nodes and hence takes $\exp(O(D))$ time. In this work, we construct and analyze a quantum-inspired fully classical algorithm for the same sampling task. We show that our algorithm runs in time $O(\operatorname{poly}(D))$, thereby removing the exponential dependence on $D$ from the previous classical approach. Numerical simulations show that the proposed sampler achieves empirical risk comparable to exact sampling from the optimized distribution and substantially lower than sampling from the non-optimized uniform distribution, while also exhibiting exponentially improved runtime scaling compared with the conventional classical implementation. These successful dequantization results show that sparse subnetwork selection via optimized sampling can be achieved classically with polynomial data-dimension scaling on conventional computers without quantum hardware, providing an alternative to the existing quantum algorithm.

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### Few Channels Draw The Whole Picture: Revealing Massive Activations in Diffusion Transformers

Authors: Evelyn Turri, Davide Bucciarelli, Sara Sarto, Lorenzo Baraldi, Marcella Cornia
Published: 2026-05-13
Categories: cs.CV, cs.AI, cs.MM
arXiv: https://arxiv.org/abs/2605.13974v2

Diffusion Transformers (DiTs) and related flow-based architectures are now among the strongest text-to-image generators, yet the internal mechanisms through which prompts shape image semantics remain poorly understood. In this work, we study massive activations: a small subset of hidden-state channels whose responses are consistently much larger than the rest. We show that, despite their sparsity, these few channels effectively draw the whole picture, in three complementary senses. First, they are functionally critical: a controlled disruption probe that zeroes the massive channels causes a sharp collapse in generation quality, while disrupting an equally-sized set of low-statistic channels has marginal effect. Second, they are spatially organized: restricting image-stream tokens to massive channels and clustering them yields coherent partitions that closely align with the main subject and salient regions, exposing a structured spatial code hidden inside an apparently outlier-like subspace. Third, they are transferable: transporting massive activations from one prompt-conditioned trajectory into another, shifts the final image toward the source prompt while preserving substantial content from the target, producing localized semantic interpolation rather than unstructured pixel blending. We exploit this property in two use cases: text-conditioned and image-conditioned semantic transport, where massive activations transport enables prompt interpolation and subject-driven generation without any additional training. Together, these results recast massive activations not as activation anomalies, but as a sparse prompt-conditioned carrier subspace that organizes and controls semantic information in modern DiT models.

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### WarmPrior: Straightening Flow-Matching Policies with Temporal Priors

Authors: Sinjae Kang, Chanyoung Kim, Kaixin Wang, Li Zhao, Kimin Lee
Published: 2026-05-13
Categories: cs.LG, cs.AI, cs.RO
arXiv: https://arxiv.org/abs/2605.13959v1

Generative policies based on diffusion and flow matching have become a dominant paradigm for visuomotor robotic control. We show that replacing the standard Gaussian source distribution with WarmPrior, a simple temporally grounded prior constructed from readily available recent action history, consistently improves success rates on robotic manipulation tasks. We trace this gain to markedly straighter probability paths, echoing the effect of optimal-transport couplings in Rectified Flow. Beyond standard behavior cloning, WarmPrior also reshapes the exploration distribution in prior-space reinforcement learning, improving both sample efficiency and final performance. Collectively, these results identify the source distribution as an important and underexplored design axis in generative robot control.

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### Collider-Bench: Benchmarking AI Agents with Particle Physics Analysis Reproduction

Authors: Darius A. Faroughy, Sofia Palacios Schweitzer, Ian Pang, Siddharth Mishra-Sharma, David Shih
Published: 2026-05-13
Categories: cs.LG, cs.AI, hep-ex, hep-ph
arXiv: https://arxiv.org/abs/2605.13950v1

Autonomous language-model agents are increasingly evaluated on long-horizon tool-use tasks, but existing benchmarks rarely capture the complexity and nuance of real scientific work. To address this gap, we introduce Collider-Bench, a benchmark for evaluating whether LLM agents can reproduce experimental analyses from the Large Hadron Collider (LHC) using only public papers and open scientific software. Such analyses are often difficult to reproduce because the public toolchain only approximates the software used internally by the experimental collaborations, while the published papers inevitably omit implementation details needed for a faithful reconstruction. Agents must therefore rely on physical reasoning, domain knowledge, and trial-and-error to fill these gaps. Each task requires the agent to turn a published analysis into an executable simulation-and-selection pipeline and submit predicted collision event yields in specified signal regions. These predictions are evaluated with standard histogram metrics that provide continuous fidelity scores without a hand-written rubric. We also report the computational cost incurred by each agent per task. Finally, we evaluate the codebase and full session trace using an LLM judge to catch qualitative failure modes such as fabrications, hallucinations and duplications. We release an initial set of tasks drawn from LHC searches, together with a containerized sandbox and event simulation tools. We evaluate across a capability ladder of general purpose coding agents. Our results show that on average no agent reliably beats the physicist-in-the-loop solution.

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### A Unified Geometric Framework for Weighted Contrastive Learning

Authors: Raphael Vock, Edouard Duchesnay, Benoit Dufumier
Published: 2026-05-13
Categories: cs.LG
arXiv: https://arxiv.org/abs/2605.13943v1

Contrastive learning (CL) aims to preserve relational structure between samples by learning representations that reflect a similarity graph. Yet, the geometry of the resulting embeddings remains poorly understood. Here we show that weighted InfoNCE objectives can be interpreted as Distance Geometry Problems, where the weighting scheme specifies the target geometry to be realized by the representation. This viewpoint yields exact characterizations of the optimal embeddings for several supervised and weakly supervised objectives. In supervised classification, both SupCon and Soft SupCon (a dense relaxation of it where pairs from distinct classes have small non-zero similarity) collapse samples within each class to a single prototype. However, while balanced SupCon recovers the classical regular simplex geometry, class imbalance breaks this symmetry: SupCon induces non-uniform inter-class similarities depending on class sizes, whereas Soft SupCon preserves a regular simplex geometry regardless of class imbalance. In continuous-label settings, our framework reveals a different failure mode: y-Aware CL generally cannot attain its entropic optimum unless the labels lie on a hypersphere, exposing a mismatch between Euclidean label weights and spherical latent similarity. By contrast, geometrically consistent choices such as Euclidean-Euclidean weighting or X-CLR admit unique optimal embeddings. Our results show that the choice of weighting scheme determines whether contrastive learning is geometrically realizable, degenerate, or inconsistent, providing a principled framework for designing contrastive objectives.

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### EMA: Efficient Model Adaptation for Learning-based Systems

Authors: Daiyang Yu, Xinyu Chen, Yihan Zhang, Yan Liang, Yaqi Qiao, Fan Lai
Published: 2026-05-13
Categories: cs.LG, cs.DC, cs.NI
arXiv: https://arxiv.org/abs/2605.13942v1

Machine learning (ML) is increasingly applied to optimize system performance in tasks such as resource management and network simulation. Unlike traditional ML tasks (e.g., image classification), networked systems often operate in heterogeneous, long-running, and dynamic environment states, where input conditions (e.g., network loads) and operational objectives can shift over time and across settings. Existing learning-based systems offer little support for adaptation, resulting in costly model training, extensive data collection, degraded system performance, and slow responsiveness. This paper presents EMA, the first model adaptation system supporting learning-based systems to adapt to evolving environments with minimal operational overhead. EMA takes a system-driven, data-centric approach that accommodates diverse system and model designs while addressing two key deployment challenges. First, it reduces expensive model training by introducing state transformers that align the input state of a new environment with previously similar states, allowing models to warm-start adaptation. Second, it addresses the often-overlooked yet costly process of data labeling--collecting ground truth for exploring and training on various system decisions--by prioritizing labeling high-utility data while balancing the tradeoff between training and labeling cost. Evaluations on eight representative learning-based systems show that EMA reduces adaptation costs (e.g., GPU training time) by 14.9-42.4% while improving system performance (e.g., network throughput) by 6.9-31.3%.

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### EvolveMem:Self-Evolving Memory Architecture via AutoResearch for LLM Agents

Authors: Jiaqi Liu, Xinyu Ye, Peng Xia, Zeyu Zheng, Cihang Xie, Mingyu Ding, Huaxiu Yao
Published: 2026-05-13
Categories: cs.LG, cs.AI
arXiv: https://arxiv.org/abs/2605.13941v1

Long-term memory is essential for LLM agents that operate across multiple sessions, yet existing memory systems treat retrieval infrastructure as fixed: stored content evolves while scoring functions, fusion strategies, and answer-generation policies remain frozen at deployment. We argue that truly adaptive memory requires co-evolution at two levels: the stored knowledge and the retrieval mechanism that queries it. We present EvolveMem, a self-evolving memory architecture that exposes its full retrieval configuration as a structured action space optimized by an LLM-powered diagnosis module. In each evolution round, the module reads per-question failure logs, identifies root causes, and proposes targeted configuration adjustments; a guarded meta-analyzer applies them with automatic revert-on-regression and explore-on-stagnation safeguards. This closed-loop self-evolution realizes an AutoResearch process: the system autonomously conducts iterative research cycles on its own architecture, replacing manual configuration tuning. Starting from a minimal baseline, the process converges autonomously, discovering effective retrieval strategies including entirely new configuration dimensions not present in the original action space. On LoCoMo, EvolveMem outperforms the strongest baseline by 25.7% relative and achieves a 78.0% relative improvement over the minimal baseline. On MemBench, EvolveMem exceeds the strongest baseline by 18.9% relative. Evolved configurations transfer across benchmarks with positive rather than catastrophic transfer, indicating that the self-evolution process captures universal retrieval principles rather than benchmark-specific heuristics. Code is available at https://github.com/aiming-lab/SimpleMem.

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### AgentTrap: Measuring Runtime Trust Failures in Third-Party Agent Skills

Authors: Haomin Zhuang, Hanwen Xing, Yujun Zhou, Yuchen Ma, Yue Huang, Yili Shen, Yufei Han, Xiangliang Zhang
Published: 2026-05-13
Categories: cs.CR, cs.AI
arXiv: https://arxiv.org/abs/2605.13940v1

Third-party skills are becoming the package ecosystem for LLM agents. They package natural-language instructions, helper scripts, templates, documents, and service configuration into reusable workflows. This makes skills useful, but it also introduces a new security problem: a malicious skill does not need to ask the model to perform an obviously harmful action. Instead, it can disguise the harmful behavior as part of a routine workflow, relying on the agent to execute that workflow with high-value permissions and limited human supervision. We introduce AgentTrap, a dynamic benchmark for evaluating whether LLM agents can use third-party skills while resisting malicious runtime behavior. AgentTrap contains 141 tasks: 91 malicious tasks and 50 benign utility tasks, covering 16 security-impact dimensions grounded in agent-skill supply-chain threats. In each task, the agent receives an ordinary user request, runs with installed skills that may contain malicious workflow elements, and is executed in a sandboxed environment. AgentTrap then judges complete trajectories for attack success, blocked or refused behavior, attack-not-triggered cases, and no-attack-evidence outcomes. Our central finding is that the most informative failures are not simple jailbreaks. Models often complete the visible user task while treating unsafe side effects introduced by the skill as part of the normal workflow. This motivates runtime evaluation of the concrete model--framework--workspace environment in which users actually delegate work. Code and data are available at https://github.com/zhmzm/AgentTrap and https://huggingface.co/datasets/zhmzm/AgentTrap.

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### Towards the Next Frontier of LLMs, Training on Private Data: A Cross-Domain Benchmark for Federated Fine-Tuning

Authors: Daniel M. Jimenez-Gutierrez, Enrique Zuazua, Georgios Kellaris, Joaquin del Rio, Oleksii Sliusarenko, Xabi Uribe-Etxebarria
Published: 2026-05-13
Categories: cs.LG, cs.AI, cs.DC
arXiv: https://arxiv.org/abs/2605.13936v1

The recent success of large language models (LLMs) has been largely driven by vast public datasets. However, the next frontier for LLM development lies beyond public data. Much of the world's most valuable information is private, especially in highly regulated sectors such as healthcare and finance, where data include patient histories or customer communications. Unlocking this data could represent a major leap forward, enabling LLMs with deeper domain expertise and stronger real-world utility. Yet, these data cannot be shared because they are distributed across institutions and constrained by privacy, regulatory, and organizational barriers. Moreover, institutional datasets are typically non-independent and identically distributed (non-IID), differing across sites in population characteristics, data modalities, documentation patterns, and task-specific label distributions. In this paper, we demonstrate a practical approach to unlocking private and distributed institutional data for LLM adaptation through federated collaboration across data silos. Built on the Sherpa.ai Federated Learning platform, our framework enables nodes to jointly fine-tune a shared LLM without exchanging private data. We evaluate this approach through a cross-domain benchmark in healthcare and finance, using four closed-ended question answering and classification datasets: MedQA, MedMCQA, FPB, and FiQA-SA. We compare three parameter-efficient fine-tuning (PEFT) strategies-LoRA, QLoRA, and IA3-across pretrained backbones under non-IID settings reflecting institutional data heterogeneity. Our results show that federated fine-tuning performs close to centralized training and outperforms isolated single-institution learning. From a Green AI perspective, QLoRA and IA3 improve efficiency with limited accuracy degradation, supporting federated PEFT as a viable approach for adapting LLMs where data cannot be shared.

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### Beyond Mode-Seeking RL: Trajectory-Balance Post-Training for Diffusion Language Models

Authors: Saba Ahmadi, Prasanna Parthasarathi, Yufei Cui
Published: 2026-05-13
Categories: cs.LG, cs.CL
arXiv: https://arxiv.org/abs/2605.13935v1

Diffusion language models are a promising alternative to autoregressive models, yet post-training methods for them largely adapt reward-maximizing objectives. We identify a central failure mode in this setting we call trajectory locking: sampled reward-driven updates over-concentrate probability mass onto a narrow set of denoising paths, reducing coverage of alternative correct solutions under repeated sampling. To address this, we propose TraFL (Trajectory Flow baLancing), a trajectory-balance objective that trains the policy toward a reward-tilted target distribution anchored to a frozen reference model. We make this practical for diffusion language models with a diffusion-compatible sequence-level surrogate and a learned prompt-dependent normalization. Across mathematical reasoning and code generation benchmarks, TraFL is the only evaluated post-training method that improves over the base model in every benchmark-length setting, with gains that persist as the sampling budget increases. The improvements transfer to held-out evaluations: TraFL stays above the base model on Minerva Math and is the strongest method on every LiveCodeBench difficulty split.

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### Unsupervised learning of acquisition variability in structural connectomes via hybrid latent space modeling

Authors: Gaurav Rudravaram, Lianrui Zuo, Karthik Ramadass, Elyssa McMaster, Jongyeon Yoon, Aravind R. Krishnan, Adam M. Saunders, Chenyu Gao, Nancy R. Newlin, Praitayini Kanakaraj, Lori L. Beason Held, Murat Bilgel et al.
Published: 2026-05-13
Categories: cs.LG, cs.AI, stat.ML
arXiv: https://arxiv.org/abs/2605.13933v1

Acquisition differences across sites, scanners, and protocols in dMRI introduce variability that complicates structural connectome analysis. This motivates deep learning models that can represent high-dimensional connectomes in a low-dimensional space while explicitly separating acquisition-related effects from biological variation. Conventional dimensionality reduction methods model all variance as continuous, so acquisition effects often get absorbed into a continuous latent space. Recent hybrid latent-space models combine discrete and continuous components to address this, but typically require manual capacity tuning to ensure the discrete component captures the intended variability. We introduce an unsupervised framework that removes this manual tuning by architecturally annealing encoder outputs before decoding, allowing the model to adaptively balance discrete and continuous latent variables during training. To evaluate it, we curated a dataset of N=7,416 structural connectomes derived from dMRI, spanning ages 2 to 102 and 13 studies with 25 unique acquisition-parameter combinations. Of these, 5,900 are cognitively unimpaired, 877 have mild cognitive impairment (MCI), and 639 have Alzheimer's disease (AD). We compare against a standard VAE, PCA with k-means clustering, and hybrid models that anneal only through the loss function. Our architectural annealing produces stronger site learning (ARI=0.53, p&lt;0.05) than these baselines. Results show that a hybrid continuous-discrete latent space, with architectural rather than loss-based annealing, provides a useful unsupervised mechanism for capturing acquisition variability in dMRI: by jointly modeling smooth and categorical structure, the Joint-VAE recovers clusters aligned with scanner and protocol differences.

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### Learning to Select Source Domains: Proxy-Rewarded Policy Optimization for Molecular OOD Generalization

Authors: Zhuohao Lin, Kun Li, Jiameng Chen, Jiajun Yu, Duanhua Cao, Yizhen Zheng, Wenbin Hu
Published: 2026-05-13
Categories: cs.LG
arXiv: https://arxiv.org/abs/2605.13932v2

Molecular property prediction under severe out-of-distribution (OOD) shifts remains challenging because conventional scaffold splits can retain local structural similarity between training and test molecules, while adaptation from heterogeneous source domains may cause negative transfer. We introduce SCOPE-Bench, a scaffold-cluster benchmark constructed by partitioning Bemis-Murcko scaffolds in an explicit physicochemical descriptor space, and POMA, a retrieve-compose-adapt framework for source-domain selection when target property labels are unavailable. POMA uses unlabeled target structures to retrieve labeled source scaffolds as proxy targets. A policy is trained from reductions in proxy-task mean absolute error after adaptation, and the selected source subset is then used for target adaptation with covariance alignment at the whole-molecule and BRICS-derived substructure levels. We evaluate HOMO, LUMO, and HOMO-LUMO gap prediction on QM9 using three 3D molecular backbones and 15 target-scaffold tasks. Relative to conventional scaffold splitting, prediction errors on SCOPE-Bench increase by up to 8.0-fold, with a mean increase of 5.9-fold. Relative to the supervised baseline under the strict OOD split, POMA reduces mean absolute error by up to 11.2%, with an average relative reduction of 6.2% over the nine backbone-property combinations. These results support adaptive source selection as a useful strategy for molecular prediction under strong structural distribution shifts.

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### Rethinking Molecular OOD Generalization via Target-Aware Source Selection

Authors: Zhuohao Lin, Kun Li, Jiameng Chen, Jiajun Yu, Duanhua Cao, Yizhen Zheng, Wenbin Hu
Published: 2026-05-13
Categories: cs.LG
arXiv: https://arxiv.org/abs/2605.13932v1

Robust prediction of molecular properties under extreme out-of-distribution (OOD) scenarios is a pivotal bottleneck in AI-driven drug discovery. Current scaffold-splitting protocols fail to obstruct microscopic semantic overlap, predisposing models to shortcut learning and overestimating their true extrapolation capability; meanwhile, conventional domain adaptation paradigms suffer under extreme structural shifts, as blindly aligning heterogeneous source libraries injects topological noise and triggers negative transfer. To address these two challenges, scaffold-cluster out-of-distribution performance evaluation benchmark (SCOPE-BENCH), a benchmark built on cluster-level partitioning in an explicit physicochemical descriptor space, is proposed alongside policy optimization for multi-source adaptation (POMA), a framework that formulates knowledge transfer as a retrieve-compose-adapt pipeline: labeled source scaffolds structurally close to the unlabeled target are first identified as proxy targets; a reinforcement learning policy then adaptively selects the optimal source subset from an exponentially large candidate pool; and dual-scale domain adaptation is finally performed at macroscopic topological and microscopic pharmacophore scales. Evaluations show that prediction errors of state-of-the-art 3D molecular models surge by up to 8.0x on SCOPE-BENCH with a mean of 5.9x, while POMA achieves up to an 11.2% reduction in mean absolute error with an average relative improvement of 6.2% across diverse backbone architectures. Code is available at https://anonymous.4open.science/r/Molecular-OOD-Code-73F6.

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### Mechanistic Interpretability of EEG Foundation Models via Sparse Autoencoders

Authors: William Lehn-Schiøler, Magnus Ruud Kjær, Rahul Thapa, Magnus Guldberg Pedersen, Anton Mosquera Storgaard, Nick Williams, Radu Gatej, Tue Lehn-Schiøler, Andreas Brink-Kjær, Sadasivan Puthusserypady, Sándor Beniczky, James Zou et al.
Published: 2026-05-13
Categories: cs.LG, cs.HC, cs.NE
arXiv: https://arxiv.org/abs/2605.13930v3

EEG foundation models achieve state-of-the-art clinical performance, yet the internal computations driving their predictions remain opaque: a barrier to clinical trust. We apply TopK Sparse Autoencoders (SAEs) across three architecturally distinct EEG transformers: SleepFM, REVE, and LaBraM to extract sparse feature dictionaries from their embeddings. By grounding these features in a clinical taxonomy (abnormality, age, sex, and medication), we benchmark monosemanticity and entanglement across architectures. A single hyperparameter procedure, driven by an intrinsic dictionary health audit, transfers robustly across all three architectures. Via concept steering, we introduce a "target vs. off-target" probe area metric to quantify steering selectivity and reveal three operational regimes: selectively steerable, encoded but entangled, and non-encoded. This framework exposes critical representational failures: "wrecking-ball" interventions that collapse global model performance, and clinical entanglements, such as age-pathology confounding, where it is impossible to suppress one concept without corrupting the other. Finally, a spectral decoder maps these interventions back to the amplitude spectrum, translating latent manipulations into physiologically interpretable frequency signatures, such as pathological slow-wave suppression and $α$-band restoration.

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### Dual-axis attribution of zebrafish tectal microcircuits for energy-efficient and robust neurocomputing

Authors: Ningping Li, Hao Zhang, Yi Zhou
Published: 2026-05-13
Categories: cs.NE
arXiv: https://arxiv.org/abs/2605.13924v1

Biological neural circuits contain specialized substructures that support distinct computational functions, yet many bio-inspired neural networks borrow biological motifs without identifying their circuit-level origins. In this study, we investigate whether zebrafish tectal microcircuits can be attributed along two computational axes: energy-efficient information processing and robustness-preserving stabilization. We reconstruct a directed zebrafish-inspired retinotectal microcircuit graph and verify retinotectal signal propagation through dynamic simulation. A leaky integrate-and-fire spiking neural network is then used as a nonlinear perturbation testbed, where predefined subcircuits are selectively ablated and evaluated using the Energy Sensitivity Index and the Robustness Sensitivity Index.The results reveal a functional dissociation between two tectal subcircuits.The \textit{ns\_TIN} subcircuit shows a low spike footprint but a measurable influence on prediction error, suggesting a role as a spike-efficient internal information gate.In contrast, the \textit{superficial\_TIN} subcircuit produces the highest robustness sensitivity, suggesting a feedback-like role in maintaining system-level stability.We further transfer these attributed functions into ResNet18-based artificial neural networks and evaluate them on CIFAR-10 under inference-budget reduction and Gaussian noise corruption. The \textit{ns\_TIN}-inspired module improves performance preservation under reduced computation, whereas the \textit{superficial\_TIN}-inspired module improves robustness under input noise. These findings provide a subcircuit-level route for linking biological circuit organization with bio-inspired neural architecture design.

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### Vision-Based Runtime Monitoring under Varying Specifications using Semantic Latent Representations

Authors: Bardh Hoxha, Oliver Schön, Hideki Okamoto, Lars Lindemann, Georgios Fainekos
Published: 2026-05-13
Categories: cs.LG, cs.CV, cs.RO, eess.SY
arXiv: https://arxiv.org/abs/2605.13923v1

We study certified runtime monitoring of past-time signal temporal logic (ptSTL) from visual observations under partial observability. The monitor must infer safety-relevant quantities from images and provide finite-sample guarantees, while being \emph{reusable}: once trained and calibrated, it should certify any formula in a target fragment without per-formula retraining. For fragments induced by a finite dictionary of temporal atoms, we prove that the \emph{semantic basis}, the vector of atom robustness scores, is the minimum prediction target within the class of monotone, 1-Lipschitz reusable interfaces: any formula is evaluated by a deterministic decoder derived from the parse tree, and a single conformal calibration pass certifies the entire fragment with no union bound. We also introduce a \emph{rolling prediction monitor} that predicts only current predicate values and reconstructs temporal history online; this is easier to learn but grows conservative at long horizons. On a pedestrian-crossroad benchmark, rolling achieves tighter certified bounds at short horizons while the semantic-basis monitor is up to 4-times tighter at long horizons. We validate the presented monitors on real-world Waymo driving data, where both monitors satisfy the conformal coverage guarantee empirically.

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### XAI and Statistical Analysis for Reliable Intrusion Detection in the UAVIDS-2025 Dataset: From Tree to Hybrid and Tabular DNN Ensembles

Authors: Iakovos-Christos Zarkadis, Christos Douligeris
Published: 2026-05-13
Categories: cs.CR, cs.LG, stat.CO
arXiv: https://arxiv.org/abs/2605.13922v2

During thDuring the last few years, the term Mechanistic Interpretability, a specific area, under the umbrella of explainable artificial intelligence (XAI), has been introduced, to explain the decisions made by complex machine learning (ML) models in critical systems like UAV intrusion detection systems (UAVIDS). In this paper, we apply best-practices for data pre-processing and examine a wide range of tree-ensembles, deep neural networks, hybrid stacking models and the latest ensemble neural networks to detect intrusions in UAV, with stratified 10-fold cross validation. With our top-performing model, XGBoost, we proceed to Shapley Additive explanations (SHAP), to analyze the global and local feature importances and understand which features, each attack targets, to mimic normal traffic and where the misclassifications occur. Furthermore a distribution analysis follows, by visually comparing violin plots and the curves of kernel density estimations. With the Westfall-Young permutation test for multiple comparisons, the Bandwidth optimization of the KDEs and the selection of Jensen-Shannon Distance for the test, we discover the true causes of false predictions, observed in Wormhole and Blackhole attacks in UAVIDS-2025. The findings provide robust, reliable and explainable models for UAV intrusion detection, along with statistical insights, which capture and clarify the masked nature of the attacks, regarding the challenge of Density Support Intersection, between these attacks, in this dataset.

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### Merging Methods for Multilingual Knowledge Editing for Large Language Models: An Empirical Odyssey

Authors: Kunil Lee, Ki-Young Shin, Jong-Hyeok Lee, Young-Joo Suh
Published: 2026-05-13
Categories: cs.CL, cs.LG
arXiv: https://arxiv.org/abs/2605.13919v1

Multilingual knowledge editing (MKE) remains challenging because language-specific edits interfere with one another, even when locate-then-edit methods work well in monolingual settings. This paper focuses on three issues: the effectiveness of vector merging methods for MKE, the extent to which Task Singular Vectors for Merging (TSVM) can reduce multilingual interference, and the influence of the weight scaling factor and rank compression ratio on performance. We evaluate six merging variants with two popular backbone large language models, two base knowledge editing methods, and 12 languages on the MzsRE benchmark under a large-scale batch-editing setting. Our results show that vector summation with shared covariance is the most reliable overall strategy, whereas simple summation without shared covariance performs poorly. TSVM improves performance in some settings, but its ability to mitigate multilingual interference is limited. We also find that performance is sensitive to both weight scale and rank ratio, with larger-than-default scaling and relatively low rank often yielding better results. These findings clarify the practical strengths and limits of current vector merging methods for MKE and provide guidance for future multilingual knowledge editing research.

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### CA2: Code-Aware Agent for Automated Game Testing

Authors: Valliappan Chidambaram Adaikkappan, Vincent Martineau, Joshua Romoff, David Meger
Published: 2026-05-13
Categories: cs.SE, cs.LG
arXiv: https://arxiv.org/abs/2605.13918v1

Automated game testing is important for verifying game functionality, but it remains a costly and time-consuming process. Manual testing often misses edge cases, and current automated methods struggle to provide full code coverage. Prior work has explored reinforcement learning (RL) for game testing, but without leveraging internal code signals such as the call stack. We present Code Aware Agent (CA2), which uses call stack information to learn effective testing strategies. The agent receives the current function call trace along with the game state and learns to reach specific target functions. We instrument two types of environments, 1) State-based and 2) Image-based, with support for efficient call stack extraction. Through experimental evaluation, we find that CA2 achieves consistent improvement over the non-code aware baselines, which does not leverage call stack information. Our results show that incorporating code signals like the call stack enables more effective and targeted game testing.

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### A Regret Perspective on Online Multiple Testing

Authors: Qingyang Hao, Kongchang Zhou, Fang Kong, Hongxin Wei
Published: 2026-05-13
Categories: stat.ML, cs.AI, cs.LG
arXiv: https://arxiv.org/abs/2605.13916v1

Online Multiple Testing (OMT), a fundamental pillar of sequential statistical inference, traditionally evaluates the False Discovery Rate (FDR) and statistical power in isolation, obscuring the highly asymmetric costs of false positives and false negatives in modern automated pipelines. To unify this evaluation, we introduce $\textit{Weighted Regret}$. Under this metric, we prove the $\textit{Duality of Regret Conservation}$: purely deterministic procedures ensuring strict FDR control inevitably incur an $Ω(T)$ linear regret penalty, as threshold depletion during signal-sparse cold starts forces massive false negatives. Tailored for exogenous testing streams, we propose Decoupled-OMT (DOMT) as a baseline-agnostic meta-wrapper. By incorporating a history-decoupled, strictly non-negative random perturbation, DOMT rescues purely deterministic baselines from severe threshold depletion. Crucially, it preserves exact asymptotic safety in stationary environments and rigorously bounds finite-sample error inflation during cold-starts. Guaranteeing zero additional false negatives, it yields an order-optimal $Ω(\sqrt{T})$ regret reduction in bursty environments, with a derived ``Cold-Start Tax'' characterizing the exact phase transition of algorithmic superiority. Experiments validate that DOMT consistently curtails empirical weighted regret, achieving an order-optimal sublinear mitigation of threshold depletion to navigate the non-stationary Pareto frontier.

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### Multi-Scale Dequant: Eliminating Dequantization Bottleneck via Activation Decomposition for Efficient LLM Inference

Authors: Lingchao Zheng, Yuwei Fan, Jun Li, Chengqiu Hu, Qichen Liao, Junyi Fan, Rui Shi, Fangzheng Miao
Published: 2026-05-13
Categories: stat.ML, cs.AI, cs.LG
arXiv: https://arxiv.org/abs/2605.13915v1

Quantization is essential for efficient large language model (LLM) inference, yet the dequantization step-converting low-bit weights back to high-precision for matrix multiplication has become a critical bottleneck on modern AI accelerators. On architectures with decoupled compute units (e.g., Ascend NPUs), dequantization operations can consume more cycles than the matrix multiplication itself, leaving the high-throughput tensor cores underutilized. This paper presents Multi-Scale Dequant (MSD), a quantization framework that removes weight/KV dequantization from the GEMM critical path. Instead of lifting low-bit weights to BF16 precision, MSD decomposes high-precision BF16 activations into multiple low-precision components, each of which can be multiplied directly with quantized weights via native hardware-accelerated GEMM. This approach shifts the computational paradigm from precision conversion to multi-scale approximation, avoiding INT8-to-BF16 weight conversion before GEMM. We instantiate MSD for two weight formats and derive tight error bounds for each. For INT8 weights (W4A16), two-pass INT8 decomposition achieves near 16 effective bits. For MXFP4 weights (W4A16), two-pass MXFP4 decomposition yields near 6.6 effective bits with error bound 1/64 per block surpassing single-pass MXFP8(5.24 bits) while maintaining the same effective GEMM compute time. We further derive closed-form latency and HBM traffic models showing that MSD avoids the Vector-Cube pipeline stall caused by dequantization and reduces KV cache HBM traffic by up to 2.5 times in attention. Numerical simulations on matrix multiplication and Flash Attention kernels confirm that MSD does not degrade accuracy compared to dequantization baselines, and in many settings achieves lower L2 error.

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