Evaluation of foundation models often rely on aggregate scores from benchmarks that lack comprehensive coverage and metadata for a fine-grained evaluation. We introduce a framework for automated benchmark generation. Our framework generates evaluation problems grounded in reference material, such as textbooks, producing benchmarks with broad coverage, rich metadata, and robustness to contamination. The pipeline employs a multi-agent architecture for problem generation and a solution-graph-driven strategy that significantly improves the reliability of ground truth solutions. Using the framework, we generate three benchmarks in Machine Learning, Corporate Finance, and Personal Finance. Expert review finds a significantly lower ground-truth error rate than previous benchmarks such as MMLU and GSM8K. Evaluation of 12 commercial and open-source models shows that our benchmarks achieve near-uniform competency coverage and surface performance differences across models that existing benchmarks fail to capture. We will open-source the framework and our curated benchmarks soon.

Digital twins (DTs) for urban transportation systems have gained increasing attention; however, their systematic evaluation in safety-critical scenarios remains limited. This paper presents a multi-pedestrian safety warning system at urban intersections enabled by a tightly coupled physical-digital twin framework. Built upon the COSMOS city-scale wireless testbed in New York City, the proposed system integrates camera and ultra-wideband (UWB), edge-cloud computing, predictive trajectory modeling, and MQTT-based communication to deliver real-time safety alerts to vulnerable road users (VRUs). The system is evaluated through both field deployment and virtual reality (VR) experiments. Results demonstrate high warning generation accuracy, localization accuracy, efficient end-to-end latency under different model configurations, and significant reductions in user response time when warnings are issued. The proposed DT framework provides a scalable, modular, and generalizable solution for real-time multi-pedestrian safety enhancement at complex urban intersections.

Post-training has become essential for adapting large language models (LLMs) to complex downstream behaviors, including instruction following, preference alignment, and multi-step reasoning. Reinforcement learning with verifiable rewards (RLVR) has recently emerged as a particularly effective post-training paradigm for improving reasoning capabilities, with critic-free algorithms such as GRPO and GSPO enabling scalable optimization. However, RLVR post-training with full fine-tuning (FFT) requires substantial GPU memory and incurs high training costs. Although parameter-efficient fine-tuning (PEFT) methods, such as Low-Rank Adaptation (LoRA), effectively reduce computational costs, they often suffer from a noticeable performance gap compared to full fine-tuning in post-training for complex reasoning tasks. In this paper, we propose Hybrid-LoRA, an efficient hybrid post-training framework that selectively applies full fine-tuning to a small subset of modules less suited to low-rank adaptation, while adapting the remaining components with LoRA. We introduce a novel Hybrid-LoRA Score to rank candidate modules according to their sensitivity to low-rank adaptation under a fixed parameter budget. Experiments show that Hybrid-LoRA closely matches full fine-tuning performance under a 10% full fine-tuning module budget, with the remaining candidate modules adapted by LoRA, consistently outperforming four state-of-the-art PEFT post-training baselines, achieving improvements of up to 5.65% and on average 4.36% over the best baseline.

Machine learning has revolutionized numerous industrial domains. Despite recent advances, machine learning models remain vulnerable to adversarial threats. Adversarial machine learning is a field that studies these vulnerabilities to build robust machine learning models. Quantum machine learning is an interdisciplinary field that bridges quantum computing and classical machine learning. While quantum machine learning shows potentials to outperform classical machine learning in complex tasks such as regression, classification, and generative modeling, it remains vulnerable to adversarial attacks. Given the recent advancements in quantum computing and machine learning, the quantum adversarial machine learning field has emerged to study the vulnerabilities of quantum machine learning, possible attacks, and novel quantum-enhanced defense strategies. In this survey, we provide a detailed overview on quantum adversarial machine learning and explore the existing attacks and countermeasures. We also review the theoretical underpinnings of this area, emerging trends, and critical challenges.

Superposition allows Transformers to reason in depth, carrying an entire reasoning frontier in parallel through a bounded-depth forward pass instead of unrolling serial chain-of-thought tokens. While Zhu et al. (2025) hand-crafted an equal-weight breadth-first frontier in a single residual stream for graph reachability, it remained open whether gradient descent could ever find this target amidst permutation-symmetric saddles. We close this gap on Reachability-by-Superposition over Erdős-Rényi graphs by isolating architectural and supervisional contributions. Architecturally, we identify a Möbius attractor: under $S_n$-symmetry in the tree regime, layerwise dynamics reduce to a 1D Möbius map whose zero set is a codimension-one manifold of global optima containing the equal-weight superposition state. On the supervision side, we identify Cascade Supervision: a loss class whose backward pass simultaneously delivers (A) selectivity bootstrap, (B) gradient persistence across depth, and (C) per-step discrimination (e.g., \mathcal{L}_{sup} and \mathcal{L}_{node}). End-to-end supervision fails condition (B) and is provably insufficient: internal gradients at layer c decay as (np)^{-(D-c-2)/2} in the graph fan-out and stall before the manifold is reached. Our thesis: Möbius attractor + Cascade Supervision = emergence of superposition reasoning. The parameter-free decay law predicts a final-step cosine of 0.35 vs. 0.71 (end-to-end vs. cascade) at depth D=3; experiments confirm 0.37 vs. 0.69, matching within 0.02 at every step.

Constant Liar (CL), Kriging Believer (KB), and fantasy models are widely used for batch selection in parallel Bayesian Optimization, yet a unified theory explaining their effectiveness and conditions under which they fail has been lacking. We identify efficient conditioning as the key surrogate property the ability to update predictions in closed form when data is augmented. We prove that Gaussian Processes satisfy this requirement, producing provably distinct batch points with separation of order l, and that this holds for any acquisition function monotonically non decreasing in posterior uncertainty (EI, UCB, PI), with qualitatively similar behavior for Thompson Sampling. We unify CL, KB, and fantasy models as instances of a single conditioning mechanism differing only in the lie value distribution, and draw quantitative connections to Local Penalization (LP) and qualitative connections to Determinantal Point Processes (DPPs). To disentangle model structure from optimizer randomness, we introduce the Structural Diversity Diagnostic (SDD), a reusable methodology for testing surrogate compatibility. Experiments on Hartmann6D, Ackley 8D, Levy10D, and SVM hyperparameter tuning validate all theoretical predictions: CL or KBs implicit penalty matches or outperforms explicit LP greedy conditioning achieves convergence on par with joint qEI efficient conditioning extends to Multiquadric RBF networks; and parametric surrogates produce degenerate batches even when fully retrained (random forests), while neural networks regain diversity only at 15x the wall clock cost of GP conditioning. Robustness is confirmed across multiple initial datasets and under observation noise.

Academic research tends to focus on new models for document understanding creating a wide gap in the literature between model definition and running models at production scale. To close that gap, we present a microservice architecture that encapsulates pipelines of multiple models for classification, optical character recognition (OCR), and large language model structured field extraction as well as our experience running this pipeline on thousands of multi-page documents per hour. We describe our primary design decisions, including a hybrid classification, separation of GPU-bound inference from CPU-bound orchestration, use of asynchronous processing for the many IO-bound operations in the pipeline, and an independent, horizontal scaling strategy. Using batch profiling, we identified two surprising qualitative findings that shape production deployments: OCR, not language-model parsing, dominates end-to-end latency, and the system saturates at a concurrency determined by shared GPU-inference capacity rather than worker count. Our goal is to provide practitioners with concrete architectural patterns for building document understanding systems that work beyond the benchmark; effectively operationalizing models in production.

Neural surrogates enable orders-of-magnitude acceleration of computational fluid dynamics (CFD) simulations, with the potential to transform engineering and healthcare workflows. Neural surrogate use in real-world applications requires addressing scalability to large, high-resolution surface and volume meshes, as well as to bespoke architectures, and accounting for limited training data through the use of inductive biases. Group-equivariant architectures are a principled way to introduce such bias, yet they can be detrimental when the learning problem itself breaks symmetry, for example, due to strong distributional alignment in the dataset. In this work, we investigate under which conditions equivariance improves generalization in neural CFD surrogates across tasks with increasing levels of distributional alignment and realism, covering automotive aerodynamics and blood flow (hemodynamics). To systematically assess the added value of equivariance at the limit of problem scaling, we introduce the Anchored-Branched Geometric Algebra Transformer (AB-GATr), a neural surrogate that integrates scalability and symmetry preservation to efficiently model coupled surface and volume quantities in an $E(3)$-equivariant manner. We find that on strongly aligned aerodynamics datasets, i.e., those that break symmetry, enforcing equivariance can degrade in-distribution performance. In contrast, across hemodynamic benchmarks with diverse geometries and varying alignment, equivariance is consistently beneficial. Moreover, across all benchmarks, the explicit equivariance of AB-GATr reliably outperforms implicit symmetry learning through data augmentation. Our findings showcase that equivariance is not universally beneficial across domains, yet it brings tangible advantages in problems lacking strong data regularities.

Modern large language model (LLM) training is inherently dynamic: resource fluctuations, RLHF phase shifts, and cluster elasticity continually reshape the optimal parallelism layout, posing a significant challenge to existing training frameworks built around a static execution model. We present DynaTrain, a distributed training system for sub-second, online reconfiguration across arbitrary multi-dimensional parallelism. At its core, we propose a Virtual Parameter Space (VPS) abstraction that unifies all distributed training states under one logical coordinate space, turning any parallelism configuration into a deterministic mapping and collapsing complex transition into manageable geometric intersections. On top of VPS, a state routing-and-transition layer executes rank-local transfers under a memory-aware, deadlock-free schedule, and an Elastic Device Manager overlaps new-world construction with ongoing training to mask topology-change cost. On dense and MoE models up to 235B parameters, DynaTrain reconfigures a 70B dense model in under 2s and a 235B MoE model in 4.36s, outperforming state-of-the-art checkpoint-based and elastic systems by up to three orders of magnitude while preserving correctness.

Trajectory-based data attribution methods estimate the influence of training samples on model predictions by unrolling the training trajectory. They are widely used in applications such as data selection, data valuation, and model diagnosis, but there is a lack of comprehensive error analysis of these methods, raising concerns about method faithfulness and hindering reliable deployment. In this work, we provide the first systematic analysis of error sources in trajectory-based data attribution, together with concrete remedies to mitigate them and practical guidelines for downstream use. We organize the total error into three categories, config-level, algorithm-level, and system-level. We make three contributions. First, we identify optimizer mismatch as the dominant config-level error: existing methods derive their attribution under the assumption of SGD, even for models trained with the modern de facto optimizer AdamW. We propose AdamW-influence to fully account for AdamW's optimization dynamics, yielding improvements from 10% to over 300% in Spearman correlation between estimated and ground-truth influence across four settings spanning MLP, CNN, GPT-2, and Llama 3.2-1B. Second, we isolate the remaining algorithm-level error arising from the first-order Taylor approximation, identify the learning rate and trajectory length as factors governing the error magnitude, and derive a closed-form error proxy that can be evaluated along the original trajectory without retraining. Third, we translate these insights into practical guidelines for data selection by unifying offline and online strategies under a K-step look-ahead framework. Under this framework, online selection with a short horizon often matches or exceeds offline, and the optimal horizon can be tuned jointly with the learning rate. Together, these results turn the framework into an actionable selection recipe for practitioners.

World models aim to predict plausible futures consistent with past observations, a capability central to planning and decision-making in reinforcement learning. Yet, existing architectures face a fundamental memory trade-off: transformers preserve local detail but are bottlenecked by quadratic attention, while recurrent and state-space models scale more efficiently but compress history at the cost of fidelity. To overcome this trade-off, we suggest decoupling future-past consistency from any single architecture and instead leveraging a set of specialized experts. We introduce a diffusion-based framework that integrates heterogeneous memory models through a contrastive product-of-experts formulation. Our approach instantiates three complementary roles: a short-term memory expert that captures fine local dynamics, a long-term memory expert that stores episodic history in external diffusion weights via lightweight test-time finetuning, and a spatial long-term memory expert that enforces geometric and spatial coherence. This compositional design avoids mode collapse and scales to long contexts without incurring a quadratic cost. Across simulated and real-world benchmarks, our method improves temporal consistency, recall of past observations, and navigation performance, establishing a novel paradigm for building and operating memory-augmented diffusion world models.

Modern NLP and LLM systems are pipelines: named entity recognition (NER) -> entity disambiguation (NED) -> entity typing, retrieval-augmented generation (retriever -> reader), and agentic chains of planner -> tool -> critic. Errors compound across stages, but existing uncertainty quantification methods either calibrate each stage independently (no joint coverage) or apply a Bonferroni union bound (joint coverage, but conservative). We present PASC (Pipeline-Aware Split Conformal), which reduces multi-stage joint coverage to a single scalar conformal prediction problem on the joint maximum nonconformity score. PASC provides a finite-sample distribution-free guarantee that all K stages are simultaneously covered with probability at least 1 - alpha, and is nearly tight up to a 1/(n+1) factor. On a three-stage NER -> NED -> entity-typing pipeline over CoNLL-2003, PASC achieves 96.4% end-to-end coverage versus 93.4% for Bonferroni and 86.5% for independent CP, at identical average prediction set size (1.083). Under distribution shift to WNUT-17 Twitter and WikiNEuRal Wikipedia data, PASC empirically maintains the target coverage in the tested shift settings while independent CP collapses to 59%. PASC requires a single quantile computation, runs 1.7x faster than Bonferroni, and scales to K = 6 stages where independent CP drops to 0.53 end-to-end coverage. The same joint-maximum-score reduction applies directly to compound LLM systems and agent pipelines.

Speculative decoding accelerates LLM inference by having a small drafter propose tokens that a larger target model verifies in parallel. Recent diffusion-based parallel drafters such as DFlash predict the full B-token block in one forward pass, enabling deeper drafters and longer accepted blocks. However, existing multi-token drafter objectives often use fixed position-dependent weighting schedules, such as head-dependent weights or block-position decays, which do not adapt as the positions limiting acceptance change during training. To address this, we derive per-position training weights from a differentiable surrogate of expected accepted draft length, matching the weight of each position to its log-probability gradient contribution. The resulting loss, D-PACE (Dynamic Position-Aware Cross-Entropy), shifts training signal toward positions that currently limit acceptance as the drafter improves. Across six benchmarks, two Qwen3-4B draft depths, two decoding temperatures, and two additional target models, D-PACE consistently improves both wall-clock speedup and average emitted length, with 2.3\% measured training-time overhead and no changes to the drafter architecture or inference procedure.

General-sum multi-agent learning is often governed by a stacked update field in which each agent's policy update changes the optimization landscape faced by the others. This coupling can entangle an integrable component of collective improvement with cyclic interaction dynamics, leading to slow or unstable multi-agent learning. Existing approaches, such as regularization, credit assignment, and consensus methods, stabilize MARL through local or algorithmic modifications; HPML complements them by projecting the joint update field onto a metric-gradient component. We introduce \textbf{HPML} (\textbf{H}odge-\textbf{P}rojected \textbf{M}ulti-agent \textbf{L}earning), which views the joint update field of a multi-agent system as an element of an $L^2$ space of vector fields and computes a Hodge-type projection onto the closest metric-gradient potential flow. HPML follows the projected component as the update direction, yielding the closest metric-gradient field under the chosen metric and sampling measure. The projection is defined variationally, characterized by a Poisson-type equation, and implemented through graph-based and amortized neural realizations that recover projected directions from samples. We show that the projected dynamics admit a Lyapunov potential and yield equilibrium-gap bounds with an explicit additive non-potentiality term. Controlled experiments validate the geometric mechanism, and CTDE benchmarks show improved stability and normalized return when HPML is used as a plug-in projection layer in MARL pipelines.

We characterize a compositional architecture of literary primitives in two instruction-tuned large language models (Llama 3.1 8B-Instruct and Gemma 2 9B-IT) via sparse autoencoders on mid-depth residual streams. Four feature classes emerge: naming-gates that promote lexical tokens of a target affect, an eleven-self cluster of first-person register features, stylistic register modulators (show-don't-tell and defamiliarization), and compositional emotions that arise only from multi-feature steering. Under a forced-choice 5-LLM judge panel applied to a 27-category emotion taxonomy (Cowen-Keltner), Llama reaches full 27/27 coverage by combining naming-gates, multi-feature recipes, and single self-feature steering; Gemma reaches 23/27 with adoration as the single residual strict-fail. Under random judging, the per-cell pass probability is on the order of $10^{-3}$ and the expected number of two-seed false-positive cells across the catalog is negligible, so the observed coverage is not consistent with chance. A cross-architectural asymmetry sits in the strict-versus-soft judge contrast: on the same generations, judges agree more often on Llama outputs than on Gemma outputs because Llama outputs name the target affect more directly while Gemma outputs evoke it through scene and imagery. Both architectures contain self-features that serve simultaneously as register markers and as emotion emitters, including a single most-RLHF-loaded self-feature per architecture that intensifies the institutional Helper-AI persona at one operating regime and produces affect-categorizable output at the same calibrated coefficient. Methodologically, the paper presents a three-stage validation pipeline (logit-lens, LLM-rate, 5-LLM judge) with documented anti-patterns; the total compute is single-GPU and about 15 minutes per emotion-feature discovery cycle.

We propose Adaptive Multi-Scale Goodness Aggregation (AMSGA), a novel extension of the Forward-Forward (FF) algorithm designed to improve stability, robustness, and generalization in local-learning neural networks. AMSGA addresses several limitations of the original FF framework by introducing multi-scale goodness aggregation across local, intermediate, and global representations; adaptive curriculum-guided hard negative mining; layer-dependent adaptive thresholds; and a warm-up cosine annealing learning-rate schedule for improved optimization stability. Together, these modifications strengthen the FF paradigm while preserving its biologically plausible and memory-efficient properties. Experiments on MNIST and Fashion-MNIST demonstrate consistent performance improvements over the baseline FF algorithm, achieving up to +1.45% improvement on MNIST and +1.50% improvement on Fashion-MNIST without significant computational overhead. Our results suggest that local learning methods can become substantially more competitive when goodness estimation and training dynamics are carefully designed.

Data is fundamental to large language models (LLMs). However, understanding of what makes certain data useful for different stages of an LLM workflow, including training, tuning, alignment, in-context learning, etc., and why, remains an open question. Current approaches rely heavily on extensive experimentation with large public datasets to obtain empirical heuristics for data filtering and dataset construction. These approaches are compute intensive and lack a principled way of understanding the essence of how specific data characteristics drive LLM behavior. In this position paper, we advocate for the need of developing systematic methodologies for generating synthetic sequences from appropriately defined random processes, with the goal that these sequences can reveal useful characteristics when they are used in one or multiple stages of the LLM workflow. We refer to such sequences as data probes. By observing LLM behavior on data probes, researchers can systematically conduct studies on how data characteristics influence model performance, generalization, and robustness. The probing sequences exhibit statistical properties that can be viewed using theoretical concepts, such as typical sets, which are generalized to describe the behaviors of LLMs. This data-probe approach provides a pathway for uncovering foundational insights into the role of data in LLM training and inference, beyond empirical heuristics.

Post-training quantization has emerged as a widely adopted technique for compressing and accelerating the inference of Large Language Models (LLMs). The primary challenges in LLMs quantization stem from activation outliers, which significantly degrade model performance especially at lower bit precision. While recent approaches attempt to mitigate outliers through linear transformations across feature dimensions, our analysis reveals that the transformed weights and activations still exhibit persistent outlier patterns with concentrated magnitude distributions. In this paper, we first model the mathematical relationship between quantization error and outliers, and then introduce a new metric Flatness to quantify the distribution of outliers. Based on this, we derive the theoretical optimal solution with respect to Flatness. Building on these insights, we propose Bidirectional Diagonal Quantization (BDQ), a novel post-training quantization framework that effectively disperses outlier patterns through optimized matrix transformations. BDQ strategically distributes outlier magnitudes across matrix dimensions via learned diagonal operations. Extensive experiments demonstrate that BDQ establishes a new quantization benchmark. It achieves less than 1\% accuracy drop in W4A4 quantization on the LLaMA-3-8B model. In the more challenging W2A4KV16 experiment, compared to state-of-the-art approaches, BDQ reduces the performance gap by 39.1\% on the DeepSeek-R1-Distill-LLaMA-70B model.

Large language models can fail in critic interaction not only by answering incorrectly, but also by abandoning an initially correct scientific solution after user criticism. This is especially risky in scientific reasoning, where user criticism can turn a valid answer into an incorrect one. We frame critic interaction as an inter-turn correctness-transition problem rather than a final-answer accuracy problem, and identify three challenges: transition awareness, decoupling useful correction from harmful sycophancy, and scalable rollout. We propose ReCrit, a transition-aware reinforcement learning framework that decomposes Initial-to-Critic behavior into four quadrants: Correction, Sycophancy, Robustness, and Boundary. ReCrit rewards correction and robustness, penalizes sycophancy, and treats persistent errors as weak boundary signals. To make interaction training practical, ReCrit further uses dynamic asynchronous rollout with tail-adaptive completion to reduce rollout waiting. On three scientific reasoning benchmarks, ChemBench, TRQA, and EarthSE, ReCrit improves average Critic accuracy from 38.15 to 51.49 on Qwen3.5-4B and from 45.40 to 55.59 on Qwen3.5-9B. Ablations show that final-answer rewards provide little interaction-level gain, while transition-aware rewards and quadrant weighting produce more distinguishable training signals and larger net Critic-stage improvement. The code is available at https://github.com/black-yt/ReCrit .

We propose non-parametric estimators for the average run length (ARL) and average detection delay (ADD) in quickest changepoint detection (QCD) under finite and irregular sequence lengths. Although ARL and ADD are widely used as optimality criteria in theoretical and simulation studies, their application to real-world datasets is hindered by limited and irregular sequence lengths. To address this issue, we propose non-parametric estimators for the ARL and ADD, termed KM-ARL and KM-ADD, by drawing an analogy between QCD and survival analysis to model detection probabilities under sequence truncation. We derive estimation bias bounds and prove that they are asymptotically unbiased unless extrapolation is required. Experiments on simulated and real-world datasets demonstrate their practical utility, enhancing robustness against limited and irregular sequence lengths, improving interpretability, and facilitating empirical, intuitive model selection. Our Python code is provided at https://github.com/TaikiMiyagawa/Kaplan-Meier-Average-Run-Length, offering ready-to-use implementations for practitioners.

LLM cascades and model routing promise lower inference cost by sending easy queries to a small model and escalating hard ones to a large model, but most deployed routers use uncalibrated confidence scores and require per-workload threshold tuning. We present UCCI, a calibration-first router that maps token-level margin uncertainty to a per-query error probability via isotonic regression and selects the escalation threshold by constrained cost minimization. Under three explicit assumptions, threshold policies on the calibrated score are cost-optimal, and isotonic calibration achieves O(n^{-1/3}) sample complexity for expected calibration error (ECE). On a production named entity recognition workload of 75,000 queries served by 4B and 12B instruction-tuned LLMs on H100 GPUs, UCCI cuts inference cost by 31% (95% CI: [27%, 35%]) at micro-F1 = 0.91 while reducing ECE from 0.12 to 0.03. At the same operating point, UCCI beats entropy thresholding, split-conformal routing, and a FrugalGPT-style learned threshold. All cascade results use end-to-end routing on actual model outputs and measured H100 latency, not simulated routing from global accuracies or nominal API prices.

Low-Rank Adaptation (LoRA) dominates parameter-efficient fine-tuning of large language models, yet most variants target dense architectures. Mixture-of-Experts (MoE) models scale parameters at near-constant per-token compute, and their sparse activation patterns create untapped opportunities for more efficient adaptation. We propose Hot-Experts Layer-level Low-Rank Adaptation (HELLoRA), which attaches LoRA modules only to the most frequently activated experts at each layer. This simple mechanism reduces trainable parameters and adapter-induced FLOPs while improving downstream performance, an effect we attribute to a form of structured regularization that preserves pretrained expert specialization. To stress-test HELLoRA under extreme parameter budgets, we further compose it with LoRI to form HELLoRI, which freezes the up-projection and sparsifies the down-projection. Across three MoE backbones, namely OlMoE-1B-7B, Mixtral-8x7B, and DeepSeekMoE, and three task families covering mathematical reasoning, code generation, and safety alignment, HELLoRA consistently outperforms strong PEFT baselines. Relative to vanilla LoRA on OlMoE, HELLoRA uses 15.7% of the trainable parameters, reduces adapter FLOPs by 38.7%, achieves 1.9x the training throughput, and improves accuracy by 9.2%. On DeepSeekMoE, HELLoRA outperforms LoRA while using only 23.2% of its trainable parameters. These results demonstrate that activation-aware adapter placement is an effective and practical route to scaling PEFT for MoE language models.

Decoupling is a powerful modeling paradigm for representing multivariate functions as compositions of linear transformations and univariate nonlinear functions. A single-layer decoupling can be viewed as a fully connected neural network with a single hidden layer and flexible activation functions, providing a direct link with neural networks. Because of this, the use of decoupling methods has gained increasing attention in neural network domains, particularly compression, since it enables structured approximations with reduced parameter complexity. Existing tensor-based decoupling methods typically rely on polynomial or piecewise-linear parameterizations of the internal nonlinear functions, which can suffer from numerical instability or limited expressiveness. In this work, we introduce a B-spline-based decoupling framework that generalizes these existing approaches. By exploiting the local support and flexible smoothness control of B-splines, the proposed formulation yields a more numerically stable and expressive representation. We derive a constrained coupled matrix-tensor factorization and propose a robust alternating least-squares algorithm, called R-CMTF-BSD, incorporating normalization and Tikhonov regularization. The proposed method is validated through experiments on synthetic data and transformer model compression. Results on the Vision and Swin Transformer architectures demonstrate that B-spline decoupling enables substantial parameter reduction while maintaining competitive accuracy, making the R-CMTF-BSD algorithm a promising tool for structured neural network compression.

Accurate spatiotemporal pattern analysis is critical in fields such as urban traffic, meteorology, and public health monitoring. However, existing methods face performance bottlenecks, typically yielding only incremental gains and often exhibiting limited cross-domain transferability. We analyze this bottleneck through spatial and temporal entropy measures, which are used as diagnostic indicators of spatiotemporal complexity mismatch rather than as guarantees that entropy alignment alone yields better forecasting. Empirically, larger mismatch is often accompanied by higher prediction uncertainty, especially under a fixed model-capacity budget. Guided by this diagnostic, we propose a scalable, adaptive framework that harmonizes spatial and temporal feature representations. Spatial dimensionality is compressed via low-rank matrix embedding to preserve essential structure, while an extended temporal horizon captures long-range dependencies and mitigates cumulative errors arising from temporal heterogeneity. Extensive experiments on urban traffic, meteorological, and epidemic datasets demonstrate substantial accuracy gains and broad applicability across the evaluated domains, suggesting that the framework is promising for a wide range of spatiotemporal tasks beyond the current study. The code is available on GitHub at https://github.com/ST-Balance/ST-Balance.

Large language models (LLMs) require reliable evaluation from pre-training to test-time scaling, making evaluation a recurring rather than one-off cost. As model scales grow and target tasks increasingly demand expert annotators, both the compute and labeling costs needed for each evaluation rise rapidly. Active testing aims to alleviate this bottleneck by approximating the evaluation result from a small but informative subset of the evaluation pool. However, existing approaches primarily target classification and break down on generative tasks. We introduce a novel active testing algorithm tailored to generative tasks. Our method leverages semantic entropy from surrogate models to stratify the evaluation pool and then conducts approximate Neyman allocation based on signals extracted from these surrogates. Across multiple language and multimodal benchmarks and a range of surrogate-target model pairs, our method significantly improves on baselines and closely tracks Oracle-Neyman, delivering up to 28% MSE reduction over Uniform Sampling and an average of 22.9% budget savings.

Many physical systems exhibit a low-dimensional structure that varies with external parameters: link lengths in a robot, forcing constants in a fluid, or Reynolds numbers in a flow shift the underlying manifold while preserving its intrinsic dimension. Constrained AutoEncoders (cAEs) learn such manifolds through an idempotent encoder-decoder projection, a property that unconstrained autoencoders cannot match and that is essential whenever the model is applied iteratively. However, the standard strategies for making a cAE context-dependent, namely concatenating the context to the input or affinely modulating hidden activations, break the encoder-decoder idempotency, sacrificing the projection guarantee precisely in the setting where it would be most valuable. To restore this guarantee under context variation, we developed the Neuromodulated Constrained Autoencoder (NcAE), which modulates the activation slope and bias of a cAE through a context-driven hyper-network. This paper presents the NcAE, its theoretical foundation, and its empirical validation. We prove that for every context, including contexts unseen at training time, the reconstruction map remains an idempotent projection, the topology of the learned manifold is invariant, and context perturbations induce smooth changes in the manifold. We evaluated our approach on a 16-DoF pendulum with context-dependent coupling and the Lorenz96 system across a bifurcation. The NcAE matched or exceeded the best of six baselines on reconstruction, idempotency, and latent-geometry metrics, while being the only architecture that preserves geometric consistency by construction. The NcAE thereby provides a stable, geometry-preserving coordinate system across families of physical regimes.

We present protein autoregressive modeling (PAR), the first multi-scale autoregressive framework for protein backbone generation via coarse-to-fine next-scale prediction. Using the hierarchical nature of proteins, PAR generates structures that mimic sculpting a statue, forming a coarse topology and refining structural details over scales. To achieve this, PAR consists of three key components: (i) multi-scale downsampling operations that represent protein structures across multiple scales during training; (ii) an autoregressive transformer that encodes multi-scale information and produces conditional embeddings to guide structure generation; (iii) a flow-based backbone decoder that generates backbone atoms conditioned on these embeddings. Moreover, autoregressive models suffer from exposure bias, caused by the training and the generation procedure mismatch, and substantially degrades structure generation quality. We effectively alleviate this issue by adopting noisy context learning and scheduled sampling, enabling robust backbone generation. Notably, PAR exhibits strong zero-shot generalization, supporting flexible human-prompted conditional generation and motif scaffolding without requiring fine-tuning. On the unconditional generation benchmark, PAR effectively learns protein distributions and produces backbones of high design quality, and exhibits favorable scaling behavior. Together, these properties establish PAR as a promising framework for protein structure generation.

Accurate multistep forecasting of node-level attributes on dynamic graphs is critical for applications ranging from financial trust networks to biological networks. Existing spatiotemporal graph neural networks typically assume a static adjacency matrix. In this work, we propose an end-to-end dynamic edge-biased spatiotemporal model that ingests a multi-dimensional timeseries of node attributes and a timeseries of adjacency matrices, to predict multiple future steps of node attributes. At each time step, our transformer-based model injects the given adjacency as an adaptable attention bias, allowing the model to focus on relevant neighbors as the graph evolves. We further deploy a masked node-time pretraining objective that primes the encoder to reconstruct missing features, and train with scheduled sampling and a horizon-weighted loss to mitigate compounding error over long horizons. Unlike prior work, our model accommodates dynamic graphs that vary across input samples, enabling forecasting in multi-system settings such as brain networks across different subjects, financial systems in different contexts, or evolving social systems. Empirical results demonstrate that our method consistently outperforms strong baselines on Root Mean Squared Error (RMSE) and Mean Absolute Error (MAE).

Spatio-temporal sensor data in real-world systems is often sparse, noisy, and irregular, making latent field reconstruction fundamentally underconstrained. Under extreme sparsity, multiple physically plausible fields may remain consistent with the same observations, requiring models to rely on inductive biases about locality, transport, and spatial regularity. In such regimes, reliable reconstruction is concentrated around the observational support induced by the sensor network, making sensor-space modeling a more identifiable objective than unconstrained global field recovery. We introduce FieldFormer, a mesh-free transformer architecture for locality-aware sensor-space modeling in persistent sensor networks. For each query, FieldFormer aggregates local evidence using learnable velocity-scaled offsets that adapt neighborhood geometry to spatio-temporal dependencies. Neighborhoods are constructed as fixed maximal sparse contexts over nearby sensors and bounded temporal windows, enabling stable and scalable inference under extreme sparsity. A local transformer encoder integrates neighborhood information, while a coordinate-based neural field formulation supports mesh-free prediction. We evaluate FieldFormer on five synthetic and real-world benchmarks, including anisotropic heat diffusion, shallow-water dynamics, atmospheric transport, and pollution monitoring datasets. Results show that locality-aware reconstruction provides strong advantages when local domains of dependence remain observed, enabling FieldFormer to consistently outperform state-of-the-art baselines on sparse sensor-space prediction tasks.

Robot manipulation policies, while central to the promise of physical AI, are highly vulnerable in the presence of external variations in the real world. Diagnosing these vulnerabilities is hindered by two key challenges: (i) the relevant variations to test against are often unknown, and (ii) direct testing in the real world is costly and unsafe. We introduce a framework that tackles both issues by learning a separate deep reinforcement learning (deep RL) policy for vulnerability prediction through virtual runs on a continuous vision-language embedding trained with limited success-failure data. By treating this embedding space, which is rich in semantic and visual variations, as a potential field, the policy learns to move toward vulnerable regions while being repelled from success regions. This vulnerability prediction policy, trained on virtual rollouts, enables scalable and safe vulnerability analysis without expensive physical trials. By querying this policy, our framework builds a probabilistic vulnerability-likelihood map. Experiments across simulation benchmarks and a physical robot arm show that our framework uncovers up to 23% more unique vulnerabilities than state-of-the-art vision-language baselines, revealing subtle vulnerabilities overlooked by heuristic testing. Additionally, we show that fine-tuning the manipulation policy with the vulnerabilities discovered by our framework improves manipulation performance with much less fine-tuning data.