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Peer-reviewade publikationer — 50304 artiklar

Data-driven complete basis set limit estimates from a minimal auxiliary basis
arXiv:2605.15927v1 Announce Type: new Abstract: Quantum chemistry calculations are often performed using atom-centered basis sets which are chosen to balance accuracy and cost. While they are systematically improvable, the total energy converges slowly with basis set size towards the complete basis set (CBS) limit. Common extrapolation methods require several intermediate-quality calculations to afford an estimate of the CBS energy. We propose combining a pairwise interaction model with a minimal complementary auxiliary basis set (CABS) baseline to estimate the CBS energy from a single quantum chemistry calculation in a minimal basis set via Kernel-Ridge-Regression (KRR), which is more efficient than both direct and $\Delta$-machine learning. We show that KRR on standard molecular representations can be improved by approximating atom-wise local kernels using Chebyshev polynomials which allows us to train KRR models efficiently on moderate compute resources, further enabling a data-driven approach towards CBS combining physical baselines capturing leading order effects with data-efficient machine learning models.
Motional-Current-Sensing Method and Simplified Closed-Loop Control Strategy for Piezoelectric-Resonator-based DC-DC Converters
arXiv:2605.15279v1 Announce Type: new Abstract: Piezoelectric resonators (PRs) have been seen as a competitive alternative to magnetic components. In PR-based converters, the motional current (in the LC series branch of the equivalent circuit) is vital for control proposes but cannot be measured directly. The difficulties to detect the zero-crossing points or to measure the amplitude of the motional current has been one of the most dominating obstacles that complicates the control strategies and limits the frequency range of the PR-based converters. This work discusses a ring-dot shaped piezoelectric transformer (PT) based motional current sensing method that provides current information with low-delay, low-loss and intrinsic isolation. It is physically proven that the proposed method is robust with various non-ideal factors of the piezoceramic and circuit implementation. Based on this, an event-driven control strategy is introduced, consisting of only a finite state machine, a PI loop, a low-speed ADC and several comparators. Experiments on a step-down PR-based converter verify that the proposed approach realize ZVS for all transitions within a switching cycle with reduced hardware and software resources, enhances stability and is capable of self-startup.
StippleDiffusion: Capacity-Constrained Stippling using Controlled Diffusion
arXiv:2605.15816v1 Announce Type: new Abstract: Stipple patterns, point sets whose local density tracks a target image, are traditionally produced by per-density iterative optimizers, which are slow, non-differentiable, and must be re-run from scratch for each new target. Learned alternatives have so far addressed only unconditional point generation; capacity-constrained, image-conditioned stippling has remained out of reach. We present the first diffusion-based sampler that simultaneously satisfies a learned local point-distribution prior and a continuous, image-defined capacity constraint at inference. The method is a ControlNet branch built on top of an optimal-transport-grid point-set diffusion baseline, conditioned on the target density map and a high-resolution image. Two design choices make the combination tractable: training and inference are restricted to the late-stage denoising regime, initialized from a density-weighted rejection sample, and the standard zero-convolution injection is replaced with a sigmoid-gated 1x1 projection that preserves the base model's blue-noise structure under hard density signals. A single trained checkpoint accepts arbitrary target densities at inference, generalizes to point budgets that were not seen during training, and produces stipples in time nearly independent of the output point count. On the Icons-50 benchmark, our learned sampler reaches parity with per-density-optimized baselines on every reported metric while remaining differentiable end-to-end.
IHF-Harmony: Multi-Modality Magnetic Resonance Images Harmonization using Invertible Hierarchy Flow Model
arXiv:2602.21536v2 Announce Type: replace Abstract: Retrospective MRI harmonization is limited by poor scalability across modalities and reliance on traveling subject datasets. To address these challenges, we introduce IHF-Harmony, a unified invertible hierarchy flow framework for multi-modality harmonization using unpaired data. By decomposing the translation process into reversible feature transformations, IHF-Harmony guarantees bijective mapping and lossless reconstruction to prevent anatomical distortion. Specifically, an invertible hierarchy flow (IHF) performs hierarchical subtractive coupling to progressively remove artefact-related features, while an artefact-aware normalization (AAN) employs anatomy-fixed feature modulation to accurately transfer target characteristics. Combined with anatomy and artefact consistency loss objectives, IHF-Harmony achieves high-fidelity harmonization that retains source anatomy. Experiments across multiple MRI modalities demonstrate that IHF-Harmony outperforms existing methods in both anatomical fidelity and downstream task performance, facilitating robust harmonization for large-scale multi-site imaging studies. Code is available at https://github.com/Idea89560041/IHF-Harmony.
Learning Disentangled Representations for Generalized Multi-view Clustering
arXiv:2605.15640v1 Announce Type: new Abstract: Multi-View Clustering (MVC) has gained significant attention for its ability to leverage complementary information across diverse views. However, existing deep MVC methods often struggle with view-distribution entanglement during cross-view fusion, which hampers the quality of the shared latent space and leads to suboptimal Figures. To address this issue, we propose the Generalized Multi-view Auto-Encoder (GMAE), a framework designed to preserve cross-view complementarity through disentangled representation learning. Specifically, GMAE employs dual-path autoencoders to decouple source features into view-specific and view-common embeddings, facilitating the discovery of clearer clustering structures. We further construct cross-view adversarial discriminators to guide view-specific encoders in capturing more discriminative features. By strategically modulating mutual information, GMAE effectively aligns distributions and prevents representation collapse, ensuring the generation of robust, non-trivial embeddings. Comprehensive experiments on 13 benchmark datasets demonstrate that GMAE consistently outperforms state-of-the-art methods in both complete and incomplete MVC tasks. Our code implementation is available at the repository: https://github.com/obananas/GMAE.
Unified High-Probability Analysis of Stochastic Variance-Reduced Estimation
arXiv:2605.15388v1 Announce Type: new Abstract: Stochastic estimators are fundamental to large-scale optimization, where population quantities must be inferred from noisy oracle observations. Although influential methods such as momentum, SPIDER, STORM, and PAGE have been highly successful, their analyses are largely estimator-specific and expectation-based, obscuring the structural tradeoffs that determine reliability. In this paper, we develop a unified framework for stochastic variance-reduced estimation based on a recursion with three components: memory retention, reset probability, and a correction term for iterate movement. This framework recovers several classical estimators, motivates new second-order variants, and yields a bias-variance decomposition of estimation error. Our main result is a unified high-probability bound proved using a new dimension-free vector-valued Freedman inequality, valid for smooth normed spaces involving random sums of vector martingales. The result applies in both Euclidean and non-Euclidean settings, including the analysis of mirror-descent-based methods in Banach spaces. As applications, we obtain high-probability oracle complexities for unconstrained optimization with mirror descent, establishing the logarithmic dependence on the confidence level. We also derive the first $\tilde{\mathcal{O}}(\varepsilon^{-3})$ oracle-complexity bounds for stochastic optimization with expectation constraints, improving upon the existing $\tilde{\mathcal{O}}(\varepsilon^{-4})$ complexity by leveraging variance-reduced estimation for the first time in this setting.
Model Reduction for Switched Linear Systems via Generalized Lyapunov Equations
arXiv:2601.13039v2 Announce Type: replace Abstract: In this work, we study projection-based model order reduction (MOR) for switched linear systems (SLS) in control form, where the projection matrices are obtained from the solutions of generalized Lyapunov equations (GLEs). We investigate how numerical inaccuracies in solving the GLEs propagate through the MOR process and impact the accuracy and reliability of the resulting reduced-order model. This highlights the importance of accounting for such inaccuracies, motivating the introduction of a novel error bound to quantify and control the error in the approximation of the GLE solution. Moreover, classical balanced truncation error estimates for SLS are neither theoretically sound nor practically applicable, as they rely on restrictive assumptions requiring several linear matrix inequalities (LMIs) to be satisfied exactly by numerically computed GLE solutions. To address these limitations, we propose a new MOR framework for SLS, termed piecewise balanced reduction (PBR). The approach is based on solving multiple GLEs and constructing projection matrices that are piecewise constant in time. By extending the standard balanced truncation error bound for SLS, we show that the PBR framework effectively controls errors arising from inexact LMI satisfaction. In addition, the proposed error bound captures the influence of the piecewise constant in time projection matrices. Altogether, this makes the PBR approach applicable to a broad and flexible class of switched linear systems. Numerical experiments are presented to support the theoretical results.
PanoWorld: Geometry-Consistent Panoramic Video World Modeling
arXiv:2605.15391v1 Announce Type: new Abstract: We present PanoWorld, a panoramic video world model that generates geometry-consistent 360$\degree$ video from a single image and a caption. Existing panoramic video methods optimize primarily for visual realism and do not explicitly constrain the underlying 3D scene state, producing outputs that appear plausible yet exhibit inconsistent depth, broken correspondences, and implausible motion across the spherical surface. We address this gap by framing panoramic video generation as a geometry- and dynamics-consistent latent state modeling problem rather than pure visual synthesis. Building on a pre-trained perspective video world model, we introduce two lightweight regularizers: a depth consistency loss against pseudo ground-truth panoramic depth, and a trajectory consistency loss that supervises the 3D world-frame positions of tracked points across time. We further apply spherical-geometry-aware adaptation to the conditioning and positional encoding. We additionally introduce PanoGeo, a unified geometry-aware panoramic video dataset with consistent depth, trajectory, and prompt annotations across diverse real and synthetic sources, used for both training and stratified evaluation. Experiments show that PanoWorld improves geometric consistency over prior panoramic generation methods while maintaining competitive visual realism, establishing that panoramic video generation must be treated as a geometric modeling problem to support the holistic spatial understanding requirements of embodied AI applications. Code is available at https://github.com/ostadabbas/PanoWorld.
ReactiveGWM: Steering NPC in Reactive Game World Models
arXiv:2605.15256v1 Announce Type: new Abstract: Current game world models simulate environments from a subjective, player-centric perspective. However, by treating the Non-Player Character (NPC) merely as background pixels, these models cannot capture interactions between the player and NPC. In that sense, they act as passive video renderers rather than real simulation engines, lacking the physical understanding needed to model action-induced NPC reactivities. We introduce ReactiveGWM, a reactive game world model that synthesizes dynamic interactions between the player and NPC. Instead of entangling all interaction dynamics, ReactiveGWM explicitly decouples player controls from NPC behaviors. Player actions are injected into the diffusion backbone via a lightweight additive bias, while high-level NPC responses (e.g., Offense, Control, Defense) are grounded through cross-attention modules. Crucially, these modules learn a game-agnostic representation of interactive logic. This enables zero-shot strategy transfer: our learned modules can be plugged directly into off-the-shelf, unannotated world models of different games. This instantly unlocks steerable NPC interactions without any domain-specific retraining. Evaluated on two Street Fighter games, ReactiveGWM maintains fine-grain player controllability while achieving robust, prompt-aligned NPC strategy adherence, paving the way for scalable, strategy-rich interaction with the NPC.
Frequency-domain Event-based Imaging for Selective Surveillance
arXiv:2605.15392v1 Announce Type: new Abstract: Event-based cameras (EBCs) are an attractive sensing modality for surveillance due to their reporting of pixel-level radiance changes with microsecond resolution and high dynamic range, enabling motion extraction while suppressing background. Their asynchronous, sparse output, however, necessitate algorithms that identify targets in event-space without processing full frames. We introduce Frequency Rate Information for Event Space (FRIES), a neuromorphic processing framework that detects periodicity in events, such as rotor rotation and mechanical vibrations, to discriminate and monitor man-made objects. FRIES first applies a time gate to suppress background and noise, then aggregates events into a pixel-wise activity (e.g., density) map and clusters pixels into regions-of-interest (ROIs). A localized spectral analysis is applied to each ROI to extract dominant frequencies used to distinguish structured object signatures from unstructured background and noise. Discriminated targets are visualized using a Resonant Time Surface (RTS), a frequency-selective method that weights events by their phase coherence with the extracted frequencies, rewarding in-sync content and suppressing out-of-sync clutter. We demonstrate FRIES and RTS in a controlled indoor experiment to recover the rotational frequency of a mechanical chopper and drone rotors against a moving background. We further test these methods on an outdoor data to detect a hovering drone against a realistic treeline. These preliminary results establish frequency-domain event processing as a promising front-end for selective surveillance in neuromorphic pipelines and a complementary surveillance modality, leveraging the high temporal resolution to enable spectral discrimination.
Probing Privacy Leaks in LLM-based Code Generation via Test Generation
arXiv:2605.15248v1 Announce Type: new Abstract: The widespread availability of large-scale code datasets has fueled the rapid development of large language models (LLMs) for code-related tasks. These datasets may include sensitive personally identifiable information (PII), which can lead to privacy leakage when LLMs memorize and reproduce it. However, existing privacy-leakage detection methods rely on ad-hoc prompt construction (manually or automatically designed). Therefore, they do not adequately approximate the real-world contexts in which PII appears in code corpora, making it difficult to extract realistic privacy leakage. In this paper, we propose a pipeline that simulates practical privacy-related code generation scenarios and adopts a test-driven strategy to elicit the memorized information from the generated test cases. We further introduce an automatically constructed privacy feature library that replaces manual prompt engineering by providing realistic templates and examples to guide test case generation. Large-scale experiments on 5 widely used LLMs show that our pipeline exposes more confirmed privacy leakage, achieving a 2.56 times increase in detected leakage compared to existing baselines.
LPDS: Evaluating LLM Robustness Through Logic-Preserving Difficulty Scaling
arXiv:2605.15393v1 Announce Type: new Abstract: As large language models (LLMs) are increasingly deployed to perform tasks with minimal human oversight, it is crucial that these models operate robustly. In particular, a model that can solve a given problem should not fail simply because certain entities$\unicode{x2013}$such as names, numbers, or other contextual details$\unicode{x2013}$have changed while the underlying problem logic remains the same. Prior work suggests that current LLMs still struggle with this form of robustness: they often succeed on some variations of a problem but fail on others. However, existing evaluations often lack a systematic way to identify which logic-preserving variations are most likely to induce failure. Instead, they typically test a random subset of allowable variations, which can overstate robustness. To address this gap, we introduce logic-preserving difficulty scaling (LPDS), a framework that (i) quantifies the difficulty of a problem variation and (ii) systematically searches the space of allowable variations to find those that maximize difficulty and expose failures. We show that as difficulty increases, performance declines and errors in the models' reasoning chains become more pronounced. We further demonstrate that LPDS efficiently finds difficult problem variations for a model, resulting in performance drops up to 5 times larger compared to random sampling. Finally, we show that fine-tuning on more difficult variations leads to more consistent robustness gains than training on easier ones.
Representation Without Reward: A JEPA Audit for LLM Fine-Tuning
arXiv:2605.15394v1 Announce Type: new Abstract: Joint-embedding predictive architectures (JEPAs) propose that a model should learn more useful abstractions when trained to predict latent representations rather than observed outputs. For autoregressive language-model fine-tuning the principle entails a stricter requirement: the induced hidden-state geometry must reach the language-model head \emph{and} improve the decoded task metric. We test that requirement under a fixed Llama-3.2-1B-Instruct LoRA harness on natural-language-to-regex generation, comparing twenty-two training-time auxiliaries across trajectory-shape regularisation, distributional constraints, predictor/target asymmetry, Fisher-metric Jacobi residuals, and a decoder-visible JEPA objective constructed to lie in cross-entropy's positive cone. The empirical answer is a structured null: several auxiliaries clear single-cell paired $\alpha = 0.10$ without correction (T3-Local at $\Delta = +2.53$~pp, $p = 0.003$ being the strongest), but none survives Bonferroni or Holm--Bonferroni at the relevant family-wise threshold, even though many change curvature, anisotropy, variance, and gradient direction. Decoder-visible JEPA yields the first positive auxiliary--cross-entropy gradient cosine in the study, yet exact match remains inside seed noise; a full-fine-tuning replication of the same auxiliary at $n = 5$ seeds reproduces the null on both benchmarks (TURK: $\Delta = +0.04$~pp, $p_{\text{paired}} = 0.96$; SYNTH: $\Delta = +0.52$~pp, $p_{\text{paired}} = 0.28$), so the null is robust across LoRA and full fine-tuning for the decoder-visible construction. Hidden-state representation work and decoded-task accuracy are therefore weakly coupled in this regime; we accordingly reframe LLM-domain JEPA evaluation as a coupling problem, in which the operative question is under which metrics useful hidden geometry becomes decoder-visible task signal.
Privacy Evaluation of Generative Models for Trajectory Generation
arXiv:2605.15246v1 Announce Type: new Abstract: Trajectory data is fundamental to modern urban intelligence, yet its sensitivity raises significant privacy concerns. Generative models such as Generative Adversarial Networks, Variational Autoencoders, and Diffusion Models have been developed to generate realistic synthetic trajectory data by capturing underlying spatiotemporal distributions and mobility patterns. Although these models are often assumed to preserve privacy due to their generative nature, this assumption does not necessarily hold. In this work, we investigate the intersection of generative trajectory modeling and privacy evaluation. By identifying applicable empirical methods for assessing privacy preservation in trajectory generation tasks, we demonstrate a significant gap in the evaluation of privacy for generative trajectory models. Motivated by this gap, we implement Membership Inference Attacks against representative models, demonstrating the feasibility of using such empirical privacy evaluation methods and showing that their generative nature does not eliminate privacy risks.
ELDOR: A Dataset and Benchmark for Illegal Gold Mining in the Amazon Rainforest
arXiv:2605.15397v1 Announce Type: new Abstract: Illegal gold mining in the Amazon rainforest causes deforestation, water contamination, and long-term ecosystem disruption, yet remains difficult to monitor at fine spatial scales. Satellite imagery supports large-scale observation, but often misses small mining-related structures and subtle land-cover transitions, especially under frequent cloud cover. We introduce ELDOR, a large-scale UAV benchmark for monitoring environmental and landscape disturbance from illegal gold mining in the rainforest. ELDOR contains manually annotated orthomosaic imagery covering over 2,500 hectares, with pixel-level semantic labels for both mining-related activities and surrounding ecological structures. With this unified annotation source, we establish four benchmark tasks: semantic segmentation, segmentation-derived recognition, direct multi-label classification, and class-presence recognition with vision-language models. Across these tasks, we compare generic and remote-sensing-specific segmentation models, vision foundation model-related segmentation methods, direct multi-label classification methods, and vision-language models under a controlled closed-set protocol. Results show that current methods still struggle with rare small-scale mining structures and fine-grained recovery classes, suggesting the need for context-aware and multimodal modeling. To support domain analysis and practical use, we further build an interactive explorer for domain experts that provides a unified interface for data exploration and model inference.
Revisiting the Frictional Control of the Antarctic Circumpolar Current From the Energy Diagram
arXiv:2602.23742v2 Announce Type: replace Abstract: The transport of the Antarctic Circumpolar Current (ACC) has been shown to increase with friction. Previous studies explained this counter-intuitive relationship called frictional control based on the eddy geometric parametrizations. They focused on the eddy momentum transfer and eddy energetics. To maintain the balance between wind stress and eddy interfacial form stress, eddy energy must remain unchanged as friction increases; this requires enhanced baroclinicity to compensate for stronger eddy energy dissipation. However, the independence of eddy energy has not been fully verified, and this interpretation assumes negligible barotropic energy conversion. To address this gap, we conduct sensitivity experiments in an idealized stratified reentrant channel with varying linear bottom drag. Numerical simulations show that eddy energy changes substantially with friction. Furthermore, in the high-drag regime, baroclinic energy conversion dominates eddy energy generation, whereas in the low-drag regime barotropic energy conversion contributes substantially. Despite these differences, baroclinicity increases with eddy energy dissipation across all regimes, although the relationship is somewhat weak in the low-drag regime owing to barotropic energy conversion. To explain this phenomenon, we extend the frictional control framework based on the Lorenz energy cycle. A simple scaling argument leads to a generalized frictional control, s~D(E)/{\tau}_w, where s is baroclinicity, D(E) is eddy energy dissipation, and {\tau}_w is wind stress. This framework provides a natural extension of the existing framework and successfully explains the numerical results. These results indicate that eddy dissipation controls the baroclinicity; therefore, properly parameterizing the eddy dissipation rate is essential for representing ACC dynamics in ocean models.
Insights on Numerical Damping Formulations Gained from Calibrating Two-Dimensional Ground Response Analyses at Downhole Array Sites
arXiv:2511.04074v2 Announce Type: replace Abstract: Accurately modeling seismic wave attenuation is critical for ground response analyses (GRAs), which aim to replicate local site effects in ground motions. However, theoretical transfer functions (TTFs) from GRAs often overestimate empirical transfer functions (ETFs) when the small-strain damping ratio ($D_{\text{min}}$) is set equal to laboratory measurements. Prior studies addressed this by inflating $D_{\text{min}}$ in one-dimensional (1D) GRAs to account for apparent damping mechanisms such as diffraction and mode conversions that cannot be captured in 1D. Although this approach improved fundamental-mode predictions, it often overdamped higher modes. This study explores more direct modeling of apparent damping using two-dimensional (2D) GRAs at four downhole array sites: Delaney Park (DPDA), I-15 (I15DA), Treasure Island (TIDA), and Garner Valley (GVDA). At each site, three numerical damping formulations, Full Rayleigh, Maxwell, and Rayleigh Mass, were implemented using both conventional $D_{\text{min}}$ and an inflated $D_{\text{min}}$ ($m \times D_{\text{min}}$) obtained from site-specific calibration. Results show that the appropriate $D_{\text{min}}$ multiplier ($m$) correlates with the site's velocity contrast. Using inflated $D_{\text{min}}$, Full Rayleigh and Maxwell damping systematically overdamped higher modes, with Maxwell damping also shifting modal peaks. In contrast, Rayleigh Mass damping consistently achieved the closest match to ETFs at three of the four sites while offering faster computational performance. These findings demonstrate that inflated $D_{\text{min}}$ can represent unmodeled attenuation in 2D GRAs, particularly at sites with low velocity contrast, and that frequency-dependent formulations such as Rayleigh Mass damping can more accurately predict site response than traditional frequency-independent approaches.
Frontier Large Language Models Rival State-of-the-Art Planners
arXiv:2511.09378v2 Announce Type: replace Abstract: A series of influential studies established that large language models cannot reliably solve even simple planning tasks. We show that the latest generation of frontier models overturns this conclusion. We evaluate three families of frontier LLMs on a challenging set of planning tasks based on the most recent International Planning Competition following rigorous evaluation guidelines: solutions are verified with a validation tool, tasks are freshly created to avoid data contamination, and performance is compared against state-of-the-art classical planners. On standard task descriptions, Gemini 3.1 Pro outperforms the strongest planner baseline (245 vs. 234 solved tasks out of 360), while GPT-5 achieves comparable performance to the baselines. When all semantic information is obfuscated from the descriptions to test for pure symbolic planning, performance degrades but Gemini 3.1 Pro remains competitive with the strongest baselines. A longitudinal comparison across model generations -- from GPT-3.5, which solves zero tasks, to GPT-5 -- reveals a striking upward trajectory. Frontier LLMs might finally be able to plan; the question now is how far this capability will extend.
From LLM-Generated Conjectures to Lean Formalizations: Automated Polynomial Inequality Proving via Sum-of-Squares Certificates
arXiv:2605.15445v1 Announce Type: new Abstract: Automated proving of polynomial inequalities is a fundamental challenge in automated mathematical reasoning, where rich algebraic structure and a rapidly growing certificate search space hinder scalability. Purely symbolic approaches provide strong guarantees but often scale poorly as the number of variables or the degree increases, due to expensive algebraic manipulations and rapidly growing intermediate expressions. In parallel, LLM-guided methods have made notable progress, particularly on competition-style inequalities with a small number of variables. To address the remaining scalability challenges, we propose NSPI, a neuro-symbolic framework that combines the complementary strengths of LLMs and symbolic computation for polynomial-inequality proving. Concretely, an LLM proposes a conjecture in the form of an approximate polynomial Sum-Of-Squares (SOS) decomposition; we refine it via symbolic computation to obtain an exact polynomial SOS representation, which directly proves the target inequality, and we further certify the proof in Lean, yielding an end-to-end pipeline from heuristic discovery to machine-checked proof. Experiments on challenging benchmarks involving polynomials with up to 10 variables demonstrate the effectiveness and scalability of the proposed method.
Quantum Artificial Intelligence for Mission-Critical Systems: Foundations, Architectural Elements, and Future Directions
arXiv:2511.09884v2 Announce Type: replace Abstract: Mission critical (MC) applications such as defense operations, energy management, cybersecurity, and aerospace control require reliable, deterministic, and low-latency decision making under uncertainty. Although the classical Artificial Intelligence (AI) approaches are effective, they often struggle to meet the stringent constraints of robustness, timing, explainability, and safety in the MC domains. Quantum Artificial Intelligence (QAI), the fusion of artificial intelligence and quantum computing (QC), can potentially provide transformative solutions to the challenges faced by classical ML models. QAI is a broader umbrella than Quantum Machine Learning (QML) and additionally includes quantum optimization, search, and reasoning; we use QAI throughout the paper for the field at large, and QML only for learning-specific subroutines. The principal contributions of this work are: (i) a systematic survey of QAI methods analyzed through the lens of MC requirements like certification, robustness, and timing; (ii) a conceptual quantum cloud resource management and scheduling framework with deployment assumptions, complexity analysis, and failure-mode discussion; and (iii) an identification of the gaps between current QAI capabilities and MC systems requirements. We also propose a conceptual model for management of quantum resources and scheduling of applications driven by timeliness constraints. We discuss multiple challenges, including trainability limits, data access, and loading bottlenecks, verification of quantum components, and adversarial QAI. Finally, we outline future research directions toward achieving interpretable, scalable, and hardware-feasible QAI models for MC application deployment.
Reading the Cell, Designing the Cure: Perturbation-Conditioned Molecular Diffusion for Function-Oriented Drug Design
arXiv:2605.15243v1 Announce Type: new Abstract: When reliable target structures are unavailable at scale or phenotypes arise from dysregulated pathways, transcriptomic perturbations provide a system-level functional readout for drug action. In this work, we formalize \emph{Transcriptome-based Drug Design (TBDD)} as a generative inverse problem: designing drug molecules conditioned on desired transcriptomic state transitions. We analyze the inherently ill-posed nature of this task, which is further complicated by the profound domain gap between biology and chemistry and by the sparsity of transcriptomic signals. To address these challenges, we propose \textbf{\themodel{}} (A \textbf{C}ell\textbf{U}lar \textbf{R}esponse \textbf{E}ngine), a multi-resolution transcriptome-guided diffusion framework. \themodel{} features a specialized \textbf{Transcriptome Perturbation Functional Feature Extractor (TFE)} that (1) distills function-oriented perturbation embeddings from pre/post states, (2) aligns these signatures to dual chemical views to bridge the cross-modal gap, and (3) performs heterogeneity-aware aggregation to extract robust state-specific signals from noisy transcriptomic data. Extensive evaluations on both standard benchmarks and rigorous out-of-distribution protocols demonstrate that \themodel{} consistently outperforms strong baselines in structural quality and functional consistency. Furthermore, we validate its practical utility via a zero-shot gene-inhibitor design task, highlighting the potential of phenotype-driven generative discovery.
RIDE: Retinex-Informed Decoupling for Exposing Concealed Objects
arXiv:2605.15450v1 Announce Type: new Abstract: Concealed Object Segmentation (COS) encompasses a family of dense-prediction tasks, including camouflaged object detection, polyp segmentation, transparent object detection, and industrial defect inspection, where targets are visually entangled with their surroundings through different physical mechanisms. Existing methods either operate directly on RGB images or employ \emph{heterogeneous} decompositions (\eg, Fourier, wavelet) that redistribute spatial evidence across scale/frequency coefficients, making pixel-aligned cues less direct. We introduce a fundamentally different perspective: \textbf{homogeneous image decomposition} via Retinex theory, which factorizes an image into illumination and reflectance components within the \emph{same} spatial domain. Our key insight is that visual entanglement enforces appearance matching in the composite space, but this does \emph{not} necessitate simultaneous matching in both component spaces, a phenomenon we formalize as the \textbf{Discriminability Gap Theorem}. Crucially, we show that across diverse COS sub-tasks, the underlying physical processes systematically anti-correlate illumination and reflectance differences, yielding theoretical guarantees that Retinex decomposition preserves or strictly improves total foreground--background discriminability across the full physical regime, with anti-correlation maximizing the gain. Building on this, we propose \textbf{RIDE} comprising: (i) a Task-Driven Retinex Decomposition module that learns segmentation-optimal factorizations end-to-end; (ii) a Discriminability Gap Attention mechanism that adaptively exploits where decomposition helps; and (iii) a Camouflage-Breaking Contrastive loss operating in reflectance feature space.
3DEditSafe: Defending 3D Editing Pipelines from Unsafe Generation
arXiv:2605.15398v1 Announce Type: new Abstract: Recent advances in 3D generative editing, particularly pipelines based on 3D Gaussian Splatting (3DGS), have achieved high-fidelity, multi-view-consistent scene manipulation from text prompts. However, we find that these pipelines also introduce new safety risks when unsafe prompts produce edits that are propagated and optimized across views. In this work, we study unsafe generation in 3D editing pipelines and show that such behavior can lead to coherent, undesirable Not-Safe-For-Work (NSFW) content in the final 3D representation. To address this, we propose 3DEditSafe, a safety-regularized 3D editing framework that constrains unsafe semantic propagation during optimization. 3DEditSafe combines generation-stage safety guidance with rendered-view 3D safety regularization, safe semantic projection, residue suppression, and mask-aware preservation to steer optimization away from unsafe editing directions. We evaluate our approach on EditSplat scenes using an object-compatible unsafe prompt benchmark and show that 2D safety guidance alone is not consistently sufficient to prevent unsafe 3D edits. 3DEditSafe reduces unsafe semantic alignment and view-level attack success rates, while revealing a safety-quality tradeoff in which stronger unsafe suppression can introduce artifacts or reduce unsafe-prompt fidelity. To our knowledge, this work is the first attempt to study and defend against unsafe generation in text-driven 3D editing pipelines, highlighting the need for safety mechanisms that operate directly on optimized 3D representations.
Logical Grammar Induction via Graph Kolmogorov Complexity: A Neuro-Symbolic Framework for Self-Healing Clinical Data Integrity
arXiv:2605.15242v1 Announce Type: new Abstract: The reliability of Healthcare Information Systems (HIS) is frequently compromised by human-induced data entry errors, which existing statistical anomaly detection methods fail to distinguish from legitimate clinical extremes. This paper proposes Logic-GNN, a novel neuro-symbolic framework that treats clinical records as a structured ``private language'' governed by latent logical games. By integrating Temporal Graph Neural Networks (TGNN) with Graph Kolmogorov Complexity, we induce a symbolic grammar that represents the underlying logic of medical interactions. We define anomalies as ``grammatical violations'' that cause a significant expansion in the Minimum Description Length (MDL) of the clinical graph. Evaluated on the Sina System dataset (2M+ records), Logic-GNN achieves an F1-score of 0.94, outperforming state-of-the-art baselines by 12\% in distinguishing between life-threatening medical outliers and data corruption. Our approach introduces a self-healing mechanism that suggests logical corrections to maintain data integrity in real-time HIS environments.
Breakeven complexity: A new perspective on neural partial differential equation solvers
arXiv:2605.15399v1 Announce Type: new Abstract: Neural surrogate solvers of partial differential equations (PDEs) promise dramatic speedups over numerical methods, especially in scenarios requiring many solves. However, current accuracy-based evaluations do not fully consider two central issues: (1) neural solvers incur substantial up-front costs for data generation, training, and tuning; and (2) classical solvers can also generate low-fidelity solutions at a sufficiently low simulation cost. To explicitly account for these realities and fully incorporate end-to-end costs, we propose an evaluation framework centered on breakeven complexity, a metric that counts the forward solves before a learned solver is cost-effective relative to an error-equivalent traditional solver. To evaluate this measure, we apply scaling laws to determine how much training budget to allocate to data generation and discuss how to achieve smooth error-matching in diverse settings. We evaluate the breakeven complexity of multiple neural PDE solvers on three PDEs on 2D periodic domains from APEBench and a novel benchmark of flows past multiple obstacles generated by the GPU-native PyFR code. Among other findings, our results suggest that neural PDE solvers become more effective as problems get harder in terms of cost, dimension, rollout, physics regime (e.g. higher Reynolds number), etc.