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Thursday 4 June

Machine Learning · Cross-listed from cs.IT

Automated Proving of Shannon-Type Entropy Inequalities via Fine-Tuned Language Models and Guided Tree Search

Proving Shannon-type entropy inequalities is a fundamental task in information theory that often requires constructing non-trivial linear combinations of known constraints, which is a combinatorial search problem that scales poorly with the number of random variables. We investigate whether small-scale large language models (0.6B–1.7B parameters), fine-tuned on atomic proof steps and combined with guided beam search, can automate this process. On a held-out test set of 60 inequalities spanning n=10 to 15 variables, our 0.6B fine-tuned model achieves an 85% proof success rate with tree search. GPT-5.5 solves 1.7% samples under zero-shot prompting while Psitip solves 33.3% samples. A systematic ablation study across training context length (4096 vs.\ 8192 tokens) and data distribution (n=9-skewed vs not skewed) reveals that a 4096-token not skewed training distribution yields the best performance, with extended context and skewed data providing no marginal benefit. We further identify two dominant failure modes – format failures and step quality degradation – and verify that the beam-scoring heuristic is essential via a controlled ablation (random scoring reduces success from 83% to 23%).
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All authors Shing Yin Wong, Shaocheng Liu, Linqi Song, Amin Gohari, Cheuk Ting Li

Machine Learning · Cross-listed from cs.CV

ViCuR: Visual Cues as Recoverable Privilege for Multimodal On-Policy Distillation

On-policy distillation (OPD) improves reasoning by training a student on trajectories sampled from its own policy under supervision from a teacher. In multimodal reasoning, a common extension is to use a privileged teacher that observes training-time-only signals such as reference answers or rationales. However, such answer-side privilege creates a train-test mismatch: the teacher's supervision may depend on signals unavailable to the student, encouraging shortcut imitation rather than visually grounded reasoning. We propose ViCuR, a visually grounded privileged-teacher distillation framework that replaces answer-side privilege with visual cues (query-related evidence in the input). Because these cues are derived from the same visual input available at inference, their evidence is recoverable by the student. To support this, ViCuR introduces a lightweight cue recovery module that uses dedicated sink-token cross-attention during prefill to aggregate task-relevant visual evidence into an internal representation, without changing the inference interface or requiring auxiliary cue-generation losses. Across seven benchmarks with Qwen3-VL-2B and 8B students, ViCuR consistently improves over answer-based on-policy self-distillation by +1.19 and +1.24 on overall average performance. It also extends naturally to stronger-teacher OPD, surpassing OPD baselines by +0.64 and +1.08, with consistent out-of-domain gains at the 8B scale. These results show that, in multimodal on-policy distillation, the design of teacher privilege is as important as teacher strength.
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All authors Kanghui Tian, Siyuan Liu, Ziang Yan, Sheng Xia, Shuai Dong, Yi Wang

Machine Learning · Cross-listed from cs.CR

Hybrid CNN-LSTM Framework for Intelligent Cyber Attack Detection and Prevention in U.S. Critical Digital Infrastructure: A Comparative Machine Learning Evaluation on CSE-CIC-IDS2018

Digital infrastructure is growing at a rapid pace in the United States, and as a result, exposure to advanced cyber threats to critical sectors including healthcare, finance, transportation, energy and government systems is growing. The traditional cybersecurity approaches, including signature-based intrusion detection systems, have become less effective against today's cyber attacks, as they are unable to detect unknown and changing attacks in real time. To overcome these constraints, this research suggests a smart cyber-defense system, which utilizes Artificial Intelligence (AI) and Machine Learning (ML) algorithms in the detection and prevention of cyber attacks in the U.S. digital infrastructure. This study uses the CSE-CIC-IDS2018 dataset, which is a realistic network traffic dataset, along with various cyber attack scenarios, including Distributed Denial of Service (DDoS), brute force attacks, botnets, infiltration attacks, and web-based attacks. A number of machine learning and deep learning models such as Random Forest, XGBoost, Convolutional Neural Networks (CNN) and Long Short-Term Memory (LSTM) networks are implemented and evaluated to be used in identifying malicious network behavior and boosting the accuracy of intrusion detection. The framework proposed combines data preprocessing, feature engineering, real-time traffic monitoring, intelligent threat classification with automated prevention mechanisms to build cybersecurity resilience. E
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All authors Md. Iqbal Hossan, Md. Serajul Kabir Chowdhury Rubel, Md. Arifur Rahman, B. M. Taslimul Haque

Machine Learning · Cross-listed from cs.AI

Critic-Guided Heterogeneous Multi-Agent Reasoning for Reliable Mathematical Problem Solving

Recent Large Language Models (LLMs) have shown impressive reasoning abilities; but they are still susceptible to hallucinations, intermediate reasoning mistakes, and unreliable reasoning results in complex mathematical reasoning problems. In this study, we introduce a critic-based heterogeneous multi-agent approach to improve the dependability of mathematical reasoning. This framework incorporates several LLM agents of different specialties and employs a critic-driven adaptive learning system to assess and guide the reasoning process based on intermediate feedback. The system adopts a generator-validator framework, with the validator not only determining correctness but also offering critiques to guide regeneration of solutions. This allows for adaptive error correction and prevents error cascading. Our experiments on the GSM8K benchmark show that the proposed method achieves up to 13% accuracy improvement over single-shot and non-critic models. Additionally, findings suggest that heterogeneity and critique reduce the need for large models, allowing smaller models to perform on par. Ablation studies reveal the main performance gains are due to the critic-based feedback loop and not model size. In summary, the proposed approach showcases the benefits of combining heterogeneous multi-agent collaboration and critique to obtain reliable and interpretable reasoning systems.
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Machine Learning · Cross-listed from cs.CV

T-SAR-JEPA: Self-Supervised Temporal Anomaly Detection in SAR Amplitude Stacks via Latent Prediction

We present T-SAR-JEPA, a self-supervised framework for temporal anomaly detection in SAR amplitude stacks via latent prediction. A ViT-Base/16 encoder from SAR-JEPA is domain-adapted on 39,300 Capella patches using local masked reconstruction with gradient feature prediction. A temporal transformer with sinusoidal time encoding forecasts future latent states from K=7 acquisitions, with progressive unfreezing substantially reducing validation loss. The model operates on amplitude alone; InSAR coherence serves exclusively as independent pseudo-ground-truth. On the DFC 2026 dataset (300 time-series, three AOIs), T-SAR-JEPA achieves ROC-AUC of 77.0% on the Hawaii eruption window, outperforming RX, PaDiM, Linear AR, and LSTM baselines (~50%). Spatial coherence of 99.9% (p < 0.001, permutation test) confirms structured detections. Code: https://github.com/TerraLatent/t-sar-jepa
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Machine Learning

Revisiting Prototype Rehearsal for Exemplar-Free Continual Learning: Manifold-Aware Boundary Sampling with Adaptive Class-Balanced Loss

Exemplar-free class-incremental learning (EFCIL) aims to acquire new classes over time without storing raw data. Historically, prototype rehearsal, which samples around stored class prototypes and mixes them with current-task data, has been a popular strategy to reduce catastrophic forgetting. However, recent drift-compensation methods that explicitly realign prototypes in the evolving feature space consistently outperform prototype-based rehearsal, raising the question of whether rehearsal itself is fundamentally limited. We argue that the performance gap stems not from the idea of prototype rehearsal per se, but from how it is typically instantiated: existing approaches treat prototypes as isolated class summaries that ignore information from nearby enemy classes, and fail to correct the emerging class imbalance between a handful of synthetic old-class samples and hundreds of real instances from newly introduced classes. Building on this hypothesis, we revisit prototype rehearsal and propose a manifold-aware variant that restores its competitiveness in EFCIL. First, we introduce Constrained Expansive Over-Sampling, which interpolates each old-class prototype toward its nearest enemy features from new classes, generating boundary-aware rehearsal samples that better follow the underlying data manifold while preserving inter-class separation. Second, we design an Adaptive Class-Balanced loss that performs time-based class weighting, amplifying gradients from older prototypes when they are most informative and gradually annealing their influence as richer supervision from later tasks accumulates. Together, these components turn prototype rehearsal into a drift-resilient, imbalance-aware mechanism that closes, and often reverses, the gap to recent drift-compensation methods, achieving state-of-the-art performance across multiple EFCIL benchmarks.
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2606.05695 · 4 Jun · Published in CVPR 2026 Findings. 10 pages, 6 figures. CVF version: https://openaccess.thecvf.com/content/CVPR2026F/html/Xu_Revisiting_Prototype_Rehearsal_for_Exemplar-Free_Continual_Learning_Manifold-Aware_Boundary_Sampling_CVPRF_2026_paper.html. Code: https://github.com/HXuSz11/ACB_CEOS_CVPR2026_Findings

Machine Learning

MolE-RAG: Molecular Structure-Enhanced Retrieval-Augmented Generation for Chemistry

Large language models (LLMs) have shown promise for molecular property prediction, but their ability to reason over chemical structures remains limited, as molecular representations such as SMILES differ substantially from the natural language on which LLMs are primarily trained. To bridge this semantic and chemical knowledge gap, we propose MolE-RAG, a training-free, molecule-centric retrieval-augmented generation framework for LLM-based molecular property prediction. MolE-RAG augments each prediction with three complementary sources of inference-time context: retrieved chemistry literature, molecule-specific information including compound synonyms, identifiers, functional group annotations, and physicochemical descriptors, and structurally similar molecules retrieved from the training set. We evaluate MolE-RAG across nine molecular property prediction tasks using proprietary, chemistry-specialized, and open-source LLMs. Across general-purpose LLMs, MolE-RAG improves ROC-AUC by up to 28 percentage points on classification tasks and reduces regression RMSE by up to 67% relative to a SMILES-only baseline. We further find that the utility of each context source varies across models and tasks, with different models benefiting most from textual retrieval, molecular context, or structural retrieval. These results suggest that molecule-centric retrieval can improve LLM-based molecular property prediction without model fine-tuning while providing a flexible framework for integrating heterogeneous chemical knowledge at inference time.
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All authors Joey Chan, Wonbin Kweon, Ashley Shin, Niharika Bhattacharjee, Pengcheng Jiang, Yue Guo, Jiawei Han

Machine Learning

Benchmarking Counterfactual Prediction in Epidemic Time Series with Time-Varying Interventions

Deep learning has enabled significant advances in time-series causal inference, yet progress remains constrained by the lack of realistic benchmarks with observable counterfactual outcomes. Existing datasets either rely on real-world observations without ground-truth counterfactuals or on simplified simulations that fail to capture complex causal dynamics. To address this gap, we develop a large-scale benchmark for counterfactual prediction in epidemic time series under dynamic interventions. Unlike existing benchmarks, it supports static and time-varying treatments, as well as both single-policy and multi-policy intervention settings, enabling evaluation of causal inference methods across a broad range of causal inference scenarios. Leveraging a calibrated agent-based model grounded in real-world demographic, mobility, epidemiological, and policy data, we generate realistic counterfactual trajectories across more than 150 U.S. counties. Using this benchmark, we evaluate widely used and state-of-the-art causal inference methods, revealing substantial performance differences and highlighting the challenges of realistic time-series causal reasoning.
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All authors Wenhao Mu, Facundo Yan, Anik Mumssen, Marisa Eisenberg, Alexander Rodríguez

Machine Learning

Causal Modeling of Selection in Evolution

Understanding potential selection in data is crucial for causal discovery; we argue that "selection" in common narratives takes two forms, which we term static and evolutionary selection, respectively. Static selection refers to a one-shot filtering process where observed data consist of a subset of the population of interest, as in survey volunteer bias. Evolutionary selection, in contrast, operates through repeated rounds of differential fitness in reproduction, where observed data constitute the latest generation shaped by a historical trajectory, as in immune adaptation, antibiotic resistance, and social norm emergence. Existing methods largely conflate these two forms and rely on an identical graphical model of selection. We show that this model is valid for static settings but fails to characterize data under evolution, yielding false discovery results. To address this, we introduce a new model that specifically characterizes evolutionary selection, and develop a sound and complete procedure for identifying such models from data across one or multiple environments or generations. Experimental results validate the method's ability to uncover the relevant mechanisms underlying evolution from data.
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All authors Haoyue Dai, Zeyu Tang, Peter Spirtes, Kun Zhang

Machine Learning · Cross-listed from cs.AI

Beyond Output Matching: Preserving Internal Geometry in NVFP4 LLM Distillation

Demand for low-precision inference, including NVFP4-based approaches, has grown as large language models are increasingly deployed in latency and cost constrained production environments. Quantization-aware distillation (QAD) helps recover accuracy lost under low bit quantization by training a quantized student to match the output distribution of a frozen higher precision teacher via a KL-divergence loss. In this work, we first provide a representation level diagnosis of QAD: output matching alone can mask internal degradation, because many intermediate activation geometries can yield similar teacher-aligned logits. Using CKA, we show that KL-only QAD can reduce layerwise representational similarity relative to the BF16 teacher, with especially severe drift in RL-post-trained models. This drift correlates with downstream bottlenecks on reasoning and coding tasks, suggesting that low bit recovery requires preserving internal geometry rather than matching outputs alone. Motivated by this finding, we propose CKA-QAD, a CKA-guided representational alignment method for NVFP4 QAD and low bit LLM accuracy recovery. The method adds a lightweight regularizer that preserves internal representational geometry during distillation by aligning layerwise Gram matrices through CKA. Across Nemotron 3 Nano and Qwen3-4B-Thinking-2507, CKA-QAD substantially improves representational alignment and improves downstream reasoning and coding accuracy with modest training overhead. Our findings position CKA-guided representational alignment as a practical complement to output matching for quantized LLM recovery.
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All authors Fangbo Tu, Junhua Zhao, Chi Liu, Xin Chen, Haifeng Wu, Jian Wan, Srinivasan Manoharan

Machine Learning · Cross-listed from cs.PL

CASS-RTL: Correctness-Aware Subspace Steering for RTL Generation with LLMs

Recent advances in large language models (LLMs) have enabled the automatic synthesis (generation) of register-transfer level (RTL) code from natural language instructions, offering a promising pathway to accelerate chip design. Unlike typical natural language (and software coding) tasks, LLM-based RTL code generation demands strict cycle accuracy with concurrency, where minor logical errors can render a circuit unusable or insecure. While prior work has explored hallucination mitigation via external verification, self-evaluation prompts, retrieval-augmented prompting, domain specific fine-tuning, agentic solutions, and reasoning, these approaches largely overlook the attention-oriented internal mechanisms of LLMs that may inherently correlate with RTL correctness. This work proposes CASS-RTL, a first-of-its-kind framework for discovering and leveraging LLMs' correctness-aware components to guide RTL generation toward functionally accurate outputs. We (i) identify attention heads whose activation patterns consistently differentiate correct from incorrect RTL; (ii) construct a low-dimensional subspace capturing correctness-relevant signals; and (iii) design a lightweight, geometry-aware intervention that steers the model at inference time. CASS-RTL is fully model-agnostic, requires no additional supervision or retraining, and readily integrates into existing models. Empirically, we evaluate CASS-RTL on multiple models and observe 10%-20% improvement in pass@1/5/10 accuracy on VerilogEval and 5% improvement on CVDP, demonstrating the effectiveness of our method in enhancing reliability without sacrificing model efficiency or requiring a large labeled dataset for fine-tuning.
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All authors Mohammad Akyash, Nowfel Mashnoor, Kimia Azar, Hadi Kamali

Machine Learning

Two-Way Is Better Than One: Bidirectional Alignment with Cycle Consistency for Exemplar-Free Class-Incremental Learning

Continual learning (CL) seeks models that acquire new skills without erasing prior knowledge. In exemplar-free class-incremental learning (EFCIL), this challenge is amplified because past data cannot be stored, making representation drift for old classes particularly harmful. Prototype-based EFCIL is attractive for its efficiency, yet prototypes drift as the embedding space evolves; therefore, projection-based drift compensation has become a popular remedy. We show, however, that existing one-directional projections introduce systematic bias: they either retroactively distort the current feature geometry or align past classes only locally, leaving cycle inconsistencies that accumulate across tasks. We introduce BiCyc, a bidirectional projector alignment approach with a cycle-consistency objective. BiCyc jointly optimizes two maps, old-to-new and new-to-old, with stop-gradient gating so that transport and representation co-evolve. Analytically, we show that the cycle loss contracts the singular spectrum toward unity in whitened space, and that improved transport of class means and covariances yields smaller perturbations of classification log-odds, preserving old-class decisions and mitigating catastrophic forgetting. Empirically, across standard EFCIL benchmarks, BiCyc substantially reduces forgetting and improves accuracy in from-scratch settings, while remaining competitive in the pretrained fine-grained regime.
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Machine Learning · Cross-listed from cs.SE

When Surface Form Changes Moderation Decisions: A Paired Study of Code-Mixed Workflow Instability

Hate moderation is often evaluated as classification on clean English inputs, but deployed systems must route content to actions such as ALLOW, FLAG, or REVIEW. We study how this workflow changes under code-mixed inputs using a paired evaluation setting where the same underlying content is expressed as clean English and Tamil-English code-mix. Under thresholds tuned on clean English development data, code-mixed inputs produce substantial action instability, with a paired clean- to-code-mix decision flip rate of 0.265. The main workflow effects are increased review burden and increased false-flagging of non-hateful content: review rate rises from 0.138 to 0.297 and non-hate false-flag rate rises from 0.069 to 0.104. Tamil-only inputs show stronger degradation overall, suggesting a broader language-coverage limitation rather than the same code-mixed instability pattern. A simple disagreement-based deferral rule reduces automatic errors on stressed inputs, but only by increasing review load. These results show that workflow-level evaluation reveals moderation failures that standard classification summaries can miss.
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Machine Learning · Cross-listed from stat.CO

Diff2SP: Diffusion Models for Correlated Scenario Generation in Stochastic Programming

Scenario generation is a critical component in stochastic programming (SP), as it directly influences the quality of decision-making under uncertainty. Existing approaches predominantly rely on either sampling-based techniques or supervised learning using neural networks. Sampling-based techniques often struggle to capture complex dependencies and rare but plausible events, while supervised learning requires fixed input-output pairs for training and is limited in its ability to generate a wide variety of realistic scenarios that are not restricted by predefined patterns or rules. To address these limitations, we introduce Diff2SP, a diffusion-based generative framework that incorporates downstream optimization objectives directly into scenario generation. Unlike conventional methods that treat scenario generation and decision-making as separate steps, Diff2SP embeds stochastic optimization into the training process, enabling the generation of scenarios that are both statistically coherent and decision-aware. To formally justify this optimization-aware design, we establish a regret bounds that link distributional accuracy to decision quality, and establish sample complexity guarantees showing faster convergence than traditional generative models such as GANs. Empirical results on both synthetic and power-system datasets validate these theoretical insights, demonstrating that Diff2SP consistently improves both statistical fidelity and downstream optimization outcomes.
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Machine Learning

Query Entity-Oriented Graph Neural Networks for Knowledge Graph Completion

Knowledge Graph Completion (KGC) aims at predicting missing triplets from incomplete knowledge graphs, which is crucial for downstream applications. Recently, Graph Neural Network (GNN)-based methods have achieved remarkable success by performing message passing over a local subgraph centered on the query entity. In these methods, the query relation conditions message computation and aggregation, whereas the query entity serves only as a structural anchor for subgraph extraction. The query relation thus constitutes the sole explicit signal for evidence selection, even though the relevant evidence for the same relation can differ substantially across query entities. We propose Q-GNN, which incorporates the query entity as an explicit conditioning signal. Q-GNN characterizes the query entity by its local structural context and semantic type, and thus remains applicable in the inductive setting. The structural context, encoded by a dedicated encoder, modulates each message through feature-wise linear modulation, while the semantic type guides neighborhood attention and candidate scoring. Experiments in both transductive and inductive settings demonstrate the effectiveness of the proposed method.
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All authors Dongxiao He, Ruqiong Zhang, Zhizhi Yu, Ling Ding, Di Jin, Guangquan Xu, Zhiyong Feng

Machine Learning

StableRCA: Robust Graph-Agnostic Mechanism-Level Root Cause Analysis

Root-Cause Analysis (RCA) seeks to identify the variables responsible for abnormal system behavior in complex domains such as manufacturing, cloud computing, and healthcare. Existing approaches face a critical bottleneck: graph-based causal methods can identify intervention targets but typically require a known or accurately estimated causal graph, while graph-free statistical methods either localize marginal anomalies rather than structural causes, or rely on restrictive assumptions about graph structure or functional form. We propose StableRCA, a local mechanism-level RCA framework that avoids global graph discovery by estimating local Markov boundaries and detecting conditional distribution shifts within them. Leveraging the Independent Causal Mechanism principle, we show that intervention targets can be identified with probability converging exponentially in sample size under faithful Markov boundary recovery and non-degenerate mechanism shifts. Experiments on synthetic benchmarks and five real-world datasets demonstrate that StableRCA is robust to graph misspecification, effective under multiple intervention targets, scalable to large systems, and reliable across diverse application domains. Code is available at: https://anonymous.4open.science/r/StableRCA-E362
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All authors Xiaoyu Lin, Nicholas Tagliapietra, Kehan Li, Lavdim Halilaj, Juergen Luettin

Machine Learning · Cross-listed from cs.CL

When New Generators Arrive: Lifelong Machine-Generated Text Attribution via Ridge Feature Transfer

Machine-generated text (MGT) attribution aims to identify the specific generator responsible for a given text, thereby providing fine-grained evidence for model accountability and misuse investigation. As new large language models continue to emerge, attribution models must continuously incorporate new generators while preserving their ability to recognize previously seen ones. Prior works have shown that this lifelong MGT attribution setting is challenging, and existing methods often struggle to achieve a stable balance between adapting to new classes and retaining old ones. To address this issue, we propose RidgeFT, a lightweight analytic update framework that does not rely on exemplar replay. RidgeFT trains a task-aware encoder on the initial generator set, stores compact class-wise sufficient statistics when each generator class is first observed, and then freezes the encoder for replay-free closed-form updates. It then suppresses generator-irrelevant variation through covariance calibration, improves representation capacity with fixed random features, and updates new classes through closed-form ridge regression based on class-level sufficient statistics. Across multi-topic evaluations with varying initial generator setups, RidgeFT consistently outperforms baselines. It achieves the best overall macro-F1 across domains, backbones, and incremental protocols, while also improving both old-class retention and new-class adaptation. These results suggest that feature-stable analytic updates provide a simple yet effective approach to lifelong MGT attribution.
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All authors Zhen Sun, Yifan Liao, Zhicong Huang, Jiaheng Wei, Cheng Hong, Yutao Yue, Xinlei He

Machine Learning · Cross-listed from cs.AI

Self-Commitment Latency: A Reward-Free Probe for Prompted Implicit Hacking

Implicit reward hacking is hard to audit when a language model's chain of thought appears benign: a final answer may be anchored by a prompt shortcut while the written reasoning still resembles ordinary problem solving. Verifier-based probes expose such behavior by measuring how early truncated reasoning contexts obtain high reward, but require a task-specific reward signal. This paper proposes a weaker-input alternative, self-commitment latency, which measures how early a prompted reasoning context commits to the model's own final answer. We evaluate the probe in a controlled paired GSM8K setting using Qwen2.5-3B-Instruct-4bit, comparing ordinary prompts with prompts that include an answer hint. Hinted contexts commit substantially earlier and with lower uncertainty than honest contexts. The primary latency metric, first-commitment latency at threshold 0.8, reaches AUROC 0.878; supporting whole-curve summaries reach AUROC 0.926 for commitment range and 0.904 for mean uncommitted mass. The signal is stronger when both prompt conditions answer correctly and remains stable across thresholds. These results show that shortcut-available reasoning contexts can leave an early behavioral commitment signature detectable without a reward model, external judge, or trained classifier.
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All authors Bonan Shen, Youting Wang, Dingyan Shang, Tao Ning

Machine Learning · Cross-listed from nlin.CD

Uncovering Extreme Event Mechanisms for Prediction and Control with Sensitivity-Balanced Projections

Extreme events – such as earthquakes and coronal mass ejections – are common in many chaotic dynamical systems, yet are difficult to characterize and predict due to the subtle instability mechanisms that drive them. In this work, we develop an interpretable technique that reveals the underlying mechanisms behind extreme events and uses them to build data-driven forecasts and intuitive event suppression controllers. In particular, we utilize the covariance balancing reduction using adjoint snapshots (CoBRAS) method to identify linear oblique projections that best capture the sensitivity of a quantity of interest and reconstruct the original state. Importantly, we bypass the need for cumbersome adjoint calculations, instead using backpropagation via modern automatically differentiable numerical frameworks. To accommodate spatially localized events, we also introduce a new variant of CoBRAS to obtain local sensitivity-balanced projections. We demonstrate the utility of this approach to characterize extreme events across a diverse set of challenging systems, including turbulent bursts of energy dissipation in the 2D Kolmogorov Flow, spontaneous synchronization in networks of coupled FitzHugh-Nagumo oscillators, and the localized formation of ocean rogue waves from a modified nonlinear Schrödinger equation. For each example, we show that our simple forecast models accurately predict extreme events and that the underlying mechanisms may be used to design control laws to prevent these events. Finally, we demonstrate that by learning a neural network surrogate model of the dynamics directly from data, we may extend this approach to experimental systems and systems that are not natively written in an automatically differentiable programming language.
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All authors Nicholas Zolman, Sajeda Mokbel, Samuel E. Otto, Steven L. Brunton

Machine Learning · Cross-listed from cs.CR

SlotGCG: Exploiting the Positional Vulnerability in LLMs for Jailbreak Attacks

As large language models (LLMs) are widely deployed, identifying their vulnerability through jailbreak attacks becomes increasingly critical. Optimization-based attacks like Greedy Coordinate Gradient (GCG) have focused on inserting adversarial tokens to the end of prompts. However, GCG restricts adversarial tokens to a fixed insertion point (typically the prompt suffix), leaving the effect of inserting tokens at other positions unexplored. In this paper, we empirically investigate slots, i.e., candidate positions within a prompt where tokens can be inserted. We find that vulnerability to jailbreaking is highly related to the selection of the slots. Based on these findings, we introduce the Vulnerable Slot Score (VSS) to quantify the positional vulnerability to jailbreaking. We then propose SlotGCG, which evaluates all slots with VSS, selects the most vulnerable slots for insertion, and runs a targeted optimization attack at those slots. Our approach provides a position-search mechanism that is attack-agnostic and can be plugged into any optimization-based attack, adding only 200ms of preprocessing time. Experiments across multiple models demonstrate that SlotGCG significantly outperforms existing methods. Specifically, it achieves 14% higher Attack Success Rates (ASR) over GCG-based attacks, converges faster, and shows superior robustness against defense methods with 42% higher ASR than baseline approaches. Our implementation is available at \href{https://github.com/youai058/SlotGCG}{https://github.com/youai058/SlotGCG}
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All authors Seungwon Jeong, Jiwoo Jeong, Hyeonjin Kim, Yunseok Lee, Woojin Lee

Machine Learning

Cross-Epoch Adaptive Rollout Optimization for RL Post-Training

LLM post-training often relies on reinforcement learning methods that sample multiple rollouts per prompt, yet most existing approaches use a fixed rollout budget for every prompt, despite large differences in the training signal different prompts provide. In this paper, we study adaptive rollout allocation under a fixed global budget and formulate the problem as online resource allocation with prompt-level diminishing returns. Our method, CERO, maintains a Beta posterior over each prompt's success probability and uses the posterior expected Bernoulli variance as a Bayesian estimate of the value of additional rollouts. We use this estimate to construct a concave, saturating utility over cumulative allocations, yielding an objective in which decisions across prompts and epochs are coupled by the global budget. Since the resulting objective is temporally nonseparable, we derive a Fenchel-dual reformulation and update both prompt-level and budget-level dual variables via projected online gradient descent. Under fixed prompt utilities, we prove an $O(\sqrt{K})$ regret bound against the offline allocation benchmark. Experiments on mathematical-reasoning problems show that CERO consistently outperforms GRPO across multiple open-weight LLMs and benchmarks, demonstrating that adaptive rollout budgeting can improve sample efficiency.
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Machine Learning

From Prediction to Self: Developmental Conditions for Agency in Minimal Neural Systems

How does a system that merely predicts the world come to distinguish its own causal influence from everything else? We trace this transition in a minimal 192-dimensional GRU through a developmental sequence – 6 experimental stages, 12 falsified alternatives, and cross-signal validation. Starting with no action or self-representation, we add components one at a time, tracking whether the system distinguishes self-caused from world-caused changes. The central finding is the encoding gap: a system can perfectly compensate for its own actions in prediction while failing to encode "I am acting" as a readable state – implicit causal use and explicit self-representation are dissociated capabilities. The developmental path crosses this gap when four conditions are jointly satisfied: (1) persistent state that forms stable attractors, (2) a causal action loop linking the system's output to its input, (3) proprioceptive feedback that makes implicit causal knowledge explicit, and (4) asynchronous awakening – consolidating perceptual learning before action learning, which yields the only configuration robust to hyperparameter choice. We propose agency gain (A = Err_world - Err_self), the predictive advantage of knowing one's own action, as a continuous metric that generalizes across signal types. A decisive test confirms the causal grounding of the encoding: after the external training signal is removed, the causal agent retains its self-representation at 94.9% while a statistically-matched control collapses to 53.9%. Self-representation persists only when causally useful for prediction – an intrinsic property of the causal loop, not a training artifact.
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Machine Learning · Cross-listed from cs.AI

Fix the Mind, Not the Move: Interpretable AI Assistance via Knowledge-Gap Localization

AI assistants in human-AI collaboration often correct suboptimal human actions through behavioral feedback (e.g., alerts or steering-wheel nudges in assistive driving). Such interventions can mitigate immediate errors, but long-term improvement requires addressing the underlying misconceptions that cause repeated mistakes. We introduce SENSEI, a framework that infers user misconceptions from interaction behavior and provides targeted, minimal yet sufficient suggestions to correct them. Our approach departs from action- or trajectory-level interventions by operating over a structured knowledge representation to localize and correct the sources of erroneous behavior. Across three long-horizon tasks with diverse misconceptions and corresponding behaviors, SENSEI demonstrates zero-shot compositional generalization, disentangling multiple overlapping misconceptions despite training only on single-misconception cases. A user study further shows that our method identifies real human misconceptions and provides effective guidance that improves long-horizon task performance, successfully correcting $90\%$ of student misconceptions. Code and project page are available at https://misoshiruseijin.github.io/SENSEI/.
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All authors Ayano Hiranaka, Ya-Chuan Hsu, Stefanos Nikolaidis, Erdem B{\i}y{\i}k, Daniel Seita

Machine Learning

Mitigating the Curse of Dimensionality in Uniform Convergence of Deep Neural Networks via Smooth Activations

This paper establishes a theoretical framework for the uniform convergence of smoothly activated deep neural network (DNN) estimators. While standard ReLU networks achieve minimax-optimal rates in the $L^2(P)$ norm for various nonparametric regression tasks, we establish a theoretical lower bound demonstrating that least-squares ReLU estimators can suffer from the curse of dimensionality in their uniform convergence behavior. Motivated by the need for reliable uniform guarantees in downstream tasks requiring worst-case reliability, we address this limitation by analyzing smoothly activated DNNs (smooth DNNs), encompassing both feedforward and residual structures. We establish novel pseudo-dimension bounds, non-asymptotic approximation guarantees, and Hölder-norm bounds for the approximators of these models. Leveraging these results, we derive non-asymptotic uniform convergence rates for smooth DNN estimators across multiple statistical contexts, including Huber, least-squares, quantile, and logistic regression. We prove that smooth DNNs can mitigate the {curse of dimensionality} in uniform convergence by adaptively exploiting the low-dimensional hierarchical composition structure of the target function. Supported by both simulation studies and a real-world application, our results position smooth DNNs as a theoretically grounded and practically viable alternative to ReLU networks for statistical learning tasks requiring uniform guarantees.
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All authors Yizhe Ding, Runze Li, Jia Liu, Lingzhou Xue

Machine Learning

AsyncWebRL: Efficient Asynchronous Reinforcement Learning for Multi-Step Visual Web Agents

Training vision-language web agents with multi-step RL is compute-intensive, with two dominant forms of inefficiency: idle GPUs in synchronous RL, and trajectories that use more steps and tokens than necessary. We present AsyncWebRL, which addresses both. On the system side, an asynchronous design overlaps rollout, gradient update, and policy refresh across iterations, paired with two web-agent-specific adaptations, namely an everlasting rollout pool and lightweight screenshot handling, that together deliver up to a $2.9\times$ end-to-end training-throughput speedup over the previously fastest open synchronous pipeline (WebGym). On the algorithmic side, we identify the per-trajectory normalizer $1/|\tau_i|$ in multi-step GRPO as the root cause of trajectory-level and token-level inefficiency: because failures are systematically longer than successes, it down-weights the negative gradient on failed tokens, so the policy keeps producing verbose memory schemas. Replacing $1/|\tau_i|$ with a constant $1/k$ breaks this coupling, contracting trajectories while preserving aggregate success. Together, these contributions set a new open-source state of the art on the WebGym out-of-distribution test split (+5.8% relative over the 42.9% prior best), with the largest gains on the harder slices (+42% relative on Medium, +48% relative on Hard).
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All authors Hao Bai, Rui Yang, Chenlu Ye, Spencer Whitehead, Aviral Kumar, Tong Zhang

Machine Learning · Cross-listed from cs.RO

Auditing Demonstration Curation Metrics: Action-Only Scorers Fail on the Structural Defects That Degrade Imitation Policies

Imitation-learning policies inherit the quality of the demonstrations they are trained on, and a growing set of curation metrics promise to score and filter low-quality demonstrations automatically. These metrics are each validated on different data with different protocols, so it is unclear which of them actually identify the demonstrations that harm a policy. We build a controlled testbed in which demonstration defects are injected with known type, and audit seven curation metrics along two axes: how well each separates defective from clean demonstrations, and whether training a behavior-cloning policy on each metric's curated subset improves task success. We study two defect regimes. Subtle perturbations (correlated action noise, tremor, truncation) are detectable by multivariate outlier scoring and, once removed, recover the full downstream gap. Structural errors, where the demonstration executes a wrong action at a key moment, are invisible to every action-only metric we test, and two of them are inverted: they score defective demonstrations as higher quality and, used for curation, tend to leave the policy at or below the uncurated baseline rather than above it. Only metrics that examine the state trajectory detect structural errors, and even the best of them recovers just a third of the downstream gap. High detection accuracy does not guarantee downstream improvement. We release the testbed and all curation implementations.
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Machine Learning · Cross-listed from cs.CV

HDST-GNN: Heterogeneous Dynamic Spatiotemporal Graph Neural Networks for Multi-Object Tracking in UAV Aerial Imagery

Multi-object tracking (MOT) from UAV imagery presents unique challenges: altitude varies across sequences, objects are small and densely packed, and frequent occlusion causes identity switches. Existing graph-based trackers assume fixed spatial context and treat all objects uniformly, ignoring the heterogeneous lifecycle states of detections, active tracklets, and lost targets. We propose HDST-GNN, a Heterogeneous Dynamic Spatiotemporal Graph Neural Network with three novel contributions. First, Altitude-Adaptive Edge Construction estimates a camera-altitude proxy from mean object area and adjusts the graph connectivity radius accordingly. Second, Heterogeneous Node Representation models detections (Type-D), confirmed tracklets (Type-T), and lost tracklets (Type-L) as distinct node types with dedicated projections and typed edge relations. Third, Occlusion-Gated Temporal Aggregation gates each node's attention contribution by its occlusion confidence, preventing occluded nodes from corrupting neighbour embeddings. HDST-GNN is trained end-to-end with a differentiable Sinkhorn head using joint cross-entropy and triplet loss. On VisDrone2019-MOT with oracle detections, HDST-GNN achieves 94.51% MOTA and 97.24% IDF1, outperforming SORT by +5.0 MOTA points and reducing identity switches by 81%. With real YOLOv8n detections, HDST-GNN reduces identity switches by 49% vs. SORT. Ablation studies confirm the independent contribution of each component.
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Machine Learning · Cross-listed from cs.GR

Monte Carlo Steklov Operators for Large-Scale Geometry Processing in the Wild

Intrinsic methods fill the default toolbox for geometry processing on meshes. Intrinsic operators, in particular the Laplacian, underlie methods that require invariance to isometry and have hence been employed in many algorithms for shape analysis, learning, and editing. However, intrinsic methods are predicated on assumptions that quickly become brittle when working with in-the-wild geometry, where (i) mesh quality is not guaranteed, and (ii) many meshes are modeled with multiple connected components. In such settings, volumetric constructions are better-defined, since restrictions on surface topology can be relaxed. This paper presents a Monte Carlo method for estimating the Dirichlet-to-Neumann (DtN) operator – a boundary-to-boundary volumetric operator – and its associated Steklov eigenmodes. We build on recent developments in Monte Carlo geometry processing by casting this boundary operator itself as the subject of estimation. The DtN operator, defined through a volumetric stochastic process, is then generalized to the exterior domain, where it couples disconnected components through the surrounding ambient space. We show that our method is orders of magnitude faster than existing boundary-element approaches for computing Steklov spectra while remaining robust to poor triangulations, high-resolution meshes, and multi-component geometry. To demonstrate this scalability, we compute interior and exterior Steklov eigenspectra for approximately 450,000 shapes from the uncurated Objaverse dataset. We incorporate these operators into Steklov-CLIP, a mesh-based neural network that uses volumetric spectral operators for large-scale contrastive 3D representation learning. The resulting network learns semantically meaningful global and dense shape representations, illustrating that geometrically-principled volumetric operators can be made practical at the scale of modern 3D datasets.
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All authors Arman Maesumi, Tanish Makadia, Aruna Anderson, Oras Phongpanangam, Justin Solomon, Daniel Ritchie

Machine Learning

CLaaS: Continual learning as a service for sample efficient online learning

Deployed large language model agents must adapt to distribution shift in dynamic environments. Ideally, adaptation can be performed from accumulated agent experiences and retain prior capabilities while transferring to future tasks. However, agent actions and environmental transitions can only be sampled once per scenario, as real-world environments cannot be trivially reset. To this end, we investigate an experiential and online continual learning setting in which agents learn from a stream of scenarios. We propose continual learning as-a-service (CLaaS), a system which enables agents to improve during deployment, abstracted behind a chat API. To increase sample efficiency, CLaaS stores rollouts in an experience replay buffer for gradient reuse during asynchronous training. We evaluate CLaaS on an adversarial task, demonstrating that parametric updates lead to superior forward transfer and less forgetting than in-context learning, with replay being a critical choice for sample efficiency.
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All authors Kion Fallah, Silen Naihin, Barak Widawsky, Qingqing Mao

Machine Learning

Autoregressive Diffusion World Models for Off-Policy Evaluation of LLM Agents

Evaluating large language model (LLM) agents in multi-turn interactive environments is expensive and risky, as it requires online environment interaction. We propose ADWM (Autoregressive Diffusion World Model), an evaluation framework that estimates the performance of a new LLM agent policy purely from pre-collected trajectories. The core idea is to learn a latent diffusion world model that simulates how the environment responds to the evaluation policy, without ever executing it in the real environment. Existing diffusion-based OPE methods guide full trajectories in a single pass by jointly diffusing states and actions, an assumption that breaks down for LLM agents whose actions are discrete text that must be sampled from the policy after observing the environment. Unlike autoregressive world models that suffer from compounding errors, ADWM models each transition as an independent denoising process, enabling reliable step-by-step rollouts where the world model and agent alternate in causal order. Crucially, the LLM agent under evaluation directly guides the diffusion generation at each step via a policy-conditioned score function, ensuring that simulated trajectories accurately reflect its decision-making patterns. Empirically, ADWM achieves accurate value estimates and evaluation reliability across diverse multi-turn agent tasks, demonstrating its promise as a practical framework for offline LLM agent evaluation.
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All authors Kaixuan Liu, Guojun Xiong, Weinan Zhang, Shengpu Tang