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Tuesday 29 September

Machine Learning (Statistics) · Cross-listed from cs.LG

Interpretable intrinsic dimension estimation through componentwise calibration of distance and angle

DANCo (Dimensionality from Angle and Norm Concentration) jointly calibrates nearest-neighbor distance and angular statistics and consistently reaches state-of-the-art accuracy on clean intrinsic-dimension (ID) benchmarks. Practical data, however, introduce neighborhood-relative noise and sample-amplitude heterogeneity that can distort these geometric signals. We reformulate DANCo componentwise, retaining separate distance and angular discrepancy curves so that the source of an estimate can be identified and interpreted. For the distance component, we derive a closed-form Kullback-Leibler divergence for the generic-order ratios of the generalized ratios ID estimator (Gride); when both angular parameters are matched (Full), Gride reduces mean percentage error from $27.7\%$ to $17.6\%$ at noise equal to $40\%$ of typical neighbor spacing on 24 manifolds. For the angular component, two sampling regimes motivate aligning mean direction while retaining concentration matching (Profiled). On a Gaussian scale mixture with generating dimension 70 embedded in 100 dimensions, profiling raises the Minimum Neighbor Distance (MiND) estimate from $22.8$ to $66.7$, while removing the known amplitudes restores MiND-Full to $71.9$; the control thus attributes the Full shortfall to amplitude heterogeneity. On CIFAR-10 and ImageNet, amplitude-reducing normalizations move angular location toward the references and narrow the Full-Profiled gap, an observational counterpart to the controlled mixture. Across four pretrained convolutional neural networks, Gride-Profiled, the two-nearest-neighbor estimator (TWO-NN), and the maximum-likelihood estimator (MLE) exhibit similar rise-and-fall profiles, while Full-Profiled differences identify the layers most sensitive to angular calibration.
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Statistical Methodology · Cross-listed from q-fin.CP

The Efficient Frontier from a LASSO Solver

Schmelzer and Hastie prove that Markowitz's Critical Line Algorithm and the LASSO path trace the same curve. This companion note checks that result numerically with a stock LASSO solver, lars\_path from scikit-learn, and no portfolio software. It covers long–short portfolios under a leverage cap, fixed leverage with varying risk appetite, and the classical long-only, fully invested frontier. Every corner the path returns meets its own optimality conditions to about $10^{-13}$ and agrees with independent quadratic-programming solvers, on factor models of up to 500 assets, on the Fama–French size and book-to-market portfolios, and on daily returns of 494 S&P~500 stocks. Called naively, the long-only path stops at the maximum-Sharpe portfolio. One shift of the response, by an amount computed in advance, lets a single call reach the minimum-variance portfolio. The script, its checks, the Fama–French returns and an R cross-check are published, with a locked environment, so that anyone can repeat them.
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Machine Learning (Statistics) · Cross-listed from cs.LG

Identifying ODEs from Unstructured Data with Causal Representation Learning

We study the problem of recovering the governing ODE of a dynamical system from unstructured, high-dimensional observations such as images. Existing methods for ODE discovery typically assume direct measurements of the variables, or do not provide theoretical guarantees on the learned variables and equations. While Causal Representation Learning (CRL) methods provide guarantees on identifying variables from high-dimensional observations up to component-wise diffeomorphisms, we show that in general these variables cannot be used directly as input to equation discovery methods, which typically assume that the variables will lead to sparse equations. So we introduce SParse Equivalent Equation Discovery AutoEncoder (SPEED-AE), a framework that combines a pretrained CRL method with a component-wise autoencoder that learns transformations of variables that are amenable to sparse ODE discovery. We show that for polynomial ODEs, this additional step allows us to restrict the identifiability of each variable from polynomial to monomial diffeomorphisms. Experiments on Lotka-Volterra, Lorenz, and a two-pendulum system show that SPEED-AE improves on the disentanglement of the CRL methods and that it recovers ODEs that are closest to the ground truth, while achieving state-of-the-art forecasting performance.
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All authors Alessandro Trenta, Riccardo Massidda, Davide Bacciu, Sara Magliacane

Statistical Methodology

A statistical framework for identifying subgroup vulnerability to predictive multiplicity in clinical AI

AI models trained on the same data can disagree about patient risk, with disagreement potentially concentrated in clinically important subgroups. We propose V(S), a statistically grounded vulnerability index combining an observable lower-bound witness of model disagreement with clinical severity, and develop inference and multiplicity-adjustment procedures for auditing prespecified subgroups. We applied the framework to two large critical-care cohorts, MIMIC-IV (n = 65,078) for model development and eICU-CRD (n = 188,230 admissions, 208 hospitals) for external validation, comparing a random forest with logistic regression across 158 prespecified subgroups. The two primary models did not both satisfy the prespecified epsilon = 0.02 Rashomon-set tolerance: the logistic-regression AUC was 0.0488 below the best candidate-model AUC. The RF-LR discrimination gap is thus interpreted as disagreement between two specific models, not as a guaranteed lower bound on the full Rashomon set. Nine subgroups had discrimination gaps distinguishable from a prespecified clinical floor. The age >=80 and cardiac subgroup had the largest point estimate of V(S) (0.307), but was underpowered and did not meet the full high-priority decision rule. The univariate cardiac subgroup (V(S) = 0.193, 95% CI [0.163, 0.223]) was the only statistically distinguishable subgroup with adequate power. Post hoc analyses identified lactate as important for both models but did not establish a causal explanation for the disagreement. Four simulation studies quantified operating characteristics of the proposed procedures, including inflated small-sample detection rates and imperfect Wald-interval coverage. The framework offers a reproducible approach for ranking subgroup vulnerability to model disagreement while separating exploratory signals from adequately supported findings.
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Machine Learning (Statistics) · Cross-listed from cs.LG

Iterative Exact Discrete Guidance for Energy-Based Sampling

Sampling from unnormalized distributions over large discrete state spaces becomes difficult when a multimodal target is far from a tractable reference. We introduce Iterative Exact Discrete Guidance (IEDG), a population-exact, trajectory-wise guidance framework for unnormalized discrete targets. Rather than learn the full reference-to-target correction in one step, IEDG introduces a global Boltzmann tilt along an annealing trajectory. Each stage learns a stage-local posterior correction for an incremental Boltzmann tilt of the current source, while the resulting corrections are accumulated relative to a fixed analytic posterior. At the population optimum, exact stage posteriors recover the correct reverse dynamics, whose exact simulation reproduces the target distribution. IEDG chooses stage increments by relative effective sample size (rESS), which controls Rényi-2 displacement and locally adapts the step size to the thermodynamic geometry of the annealing path. Our stagewise total-variation analysis shows that limited overlap amplifies Bregman fitting error by $1/\sqrt{\mathrm{rESS}}$, while posterior, simulation, and truncation errors enter additively. IEDG improves all distribution-level errors over the neural baselines on ordered, exactly enumerated Ising $4\times4$, while substantially reducing one-shot errors on Ising/Potts $16\times16$ across thermodynamic regimes and attaining the best neural-sampler result on several reported local-statistic and phase-coverage metrics. On Max-Cut, its best-of-512 and average-sample ratios exceed all the baselines. Code and artifacts are available at https://github.com/StillFantasy123/iterative-exact-discrete-guidance.
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All authors Yuwen Qian, Yidong Ouyang, Zhengyan Wan, Hongyuan Zha

Machine Learning (Statistics) · Cross-listed from cs.LG

Scalable Diffusion SBI for Compositional Inference under Simulator Misspecification

Simulation-based inference is challenging when many heterogeneous observations must be composed, hierarchical latent structure must be preserved, and the simulator is misspecified relative to observed data. We develop sampling and fine-tuning methods for diffusion-based inference in design-conditional settings, where the same simulator is queried across different experimental conditions $\xi$. We extend compositional score-based inference with a continuous-time diffusion coefficient that accounts for the number of observations, avoiding Jacobian and auxiliary-covariance corrections. We introduce Hierarchical Blockwise Diffusion Sampling (HBDS), which infers shared parameters and group-specific latent states using a single pretrained model, with the hierarchy specified only at sampling time. Together, these methods support variable observation sets and groupings without retraining. To address misspecification, we introduce path-regularized fine-tuning that adapts the learned likelihood to observations and transfers corrections to posterior inference. Using Girsanov's theorem, we quantify path divergence between pretrained and fine-tuned models across experimental designs and interpret it alongside predictive errors to distinguish candidate misspecification correction from unnecessary adaptation. We evaluate compositional sampling on exact-score Gaussian and Simple Likelihood, Complex Posterior benchmarks, HBDS with analytic and learned scores on a controlled hierarchical model, and fine-tuning and localization on a separate analytic model with known design-dependent discrepancy. Finally, we apply the framework to 940 measurements across four cell lines in a mechanistic Bone Morphogenetic Protein signaling model, where fine-tuning improves posterior-predictive accuracy relative to the pretrained model and shifts posterior marginals toward the least-squares reference while retaining spread.
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Statistical Methodology

BRP-GABLE: An Interpretable Rule-Based Prediction Framework for Multiple Outcome Types

Interpretable prediction models are important in biomedical research, where predictive accuracy must often be balanced against the ability to examine predictor-outcome relationships. Automatic Binary Logistic Estimation (ABLE) provides interpretable rule-based representations by constructing additive models using threshold rules. However, the original method is restricted to binary outcomes, and its greedy forward construction follows a search path, making candidate rules dependent on earlier selections and potentially excluding alternative structures. We extended ABLE to binary, continuous, and time-to-event outcomes using outcome-specific fitting criteria, yielding Generalized ABLE (GABLE). We then propose bootstrap rule pooling for GABLE (BRP-GABLE), which applies GABLE rule generation to bootstrap samples to explore alternative search paths, pool distinct rules, and perform a single global LASSO selection over the pooled rules and truncated linear terms. Unlike conventional bagging, bootstrap-specific models are not averaged, and resampling is used to diversify the candidate rule space before constructing a final model. Simulations showed that BRP-GABLE consistently improved predictive performance compared with GABLE and provided competitive prediction with relatively simple rule structures. Application to overall survival demonstrated its use for clinically interpretable prediction. BRP-GABLE provides a flexible framework for constructing sparse and interpretable predictive models across multiple outcome types.
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All authors Yulong Li, Ke Wan, Toshio Shimokawa, Kensuke Tanioka

Statistical Methodology · Cross-listed from cs.SI

Luxury resale volume and composition shifted during the COVID-19 tourism shock, but co-purchase network tests were inconclusive and construction-sensitive

Japan's 2020 tourism shock coincided with 27% fewer buyers and 35% lower gross merchandise value at one second-hand luxury resale intermediary. We compared 2019 and 2020 co-purchase projections of recorded brand labels with a Holm-corrected battery of five label-invariant metrics and Portrait Divergence against two permutation nulls rebuilding both graphs. Neither test separated the full years (smallest Holm p 0.407; 0.097 under the design-matched paired-swap null). For one random two-block split of brands, the battery detected a planted redirection of 30% of multi-brand baskets (178 of 10,399 second-group baskets, 1.7%) in 83 of 100 simulations (83-92 of 100 across 11 splits, all at least 80); Portrait Divergence reached 80% power only at full redirection. Observed falls in mean degree and clustering resembled those of 20-30% redirection, but the planted rise in degree assortativity was absent. A composition-only model of the observed attrition would be detected in only 15 of 100 simulations. Results moved with construction: without residual and material labels (post hoc), mean degree separated the years under the paired-swap null (Holm p = 0.030), and Portrait Divergence fell below 0.05, unadjusted, at the widest construction and within April-December. Shock-period network comparisons need rebuilt-graph nulls and a per-metric detection floor.
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Statistical Methodology · Cross-listed from econ.EM

Testing for Unobserved Heterogeneity in Censored Duration Models: EM Approach

Ignoring unobserved heterogeneity in duration models biases parameter estimates and invalidates inference, but testing for it is non-regular: the null hypothesis lies on the boundary of the parameter space and some parameters are unidentified under the null. These features render standard asymptotic theory inapplicable. This paper develops an EM test for unobserved heterogeneity in censored Weibull duration models, building on the EM approach of Li, Chen, and Marriott (2009). The test statistic has an asymptotic null distribution equal to the square of max{0, N(0,1)}, hence critical values require neither simulation nor bootstrap, and the test accommodates covariate-dependent censoring of arbitrary form. Monte Carlo simulations compare the EM test with the likelihood ratio test (LRT) of Cho and White (2010), information matrix tests, and Lagrange multiplier tests. The EM test has empirical size close to the nominal level for sample sizes of 500 or more, where the LRT remains markedly conservative and the other tests over-reject. Its size-adjusted power is comparable to that of the LRT and higher than that of the other tests. Because size adjustment requires knowledge of the data-generating process and is unavailable in practice, the EM test attains higher power than the LRT in most designs as the tests would actually be applied. In an application to the Stanford Heart Transplant data, the EM test rejects homogeneity in every covariate specification, whereas the LRT's conclusion depends on a user-chosen set of admissible parameter values and on the specification.
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All authors Hiroyuki Kasahara, Hirokazu Matsuyama, Katsumi Shimotsu, Shota Takeishi

Statistical Methodology

Testing Diagonal Anisotropy Based on Single Realisation of Spherical Random Field

Spherical data appear in various applications, including cosmology and the Earth sciences. A standard statistical model for such data employs isotropic spherical random fields. The isotropy assumption may be unrealistic for many real-world datasets. Also, in various applications such as cosmology, only a single realisation of the field is observed, making isotropy impossible to assess through repeated sampling. This paper considers an alternative anisotropic model, referred to as diagonal anisotropy. To test isotropy against diagonal anisotropy, we develop score and cumulative-sum-type tests. Their asymptotic properties and Monte Carlo-based alternatives suitable for moderate sample sizes are established. The performance of the proposed methods is illustrated by numerical studies via applications to simulated data and to actual Planck cosmic microwave background radiation observations. The tests are also applied to three Planck SMICA cosmic microwave background radiation maps and demonstrate how results can vary for different data releases and map construction procedures.
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Machine Learning (Statistics) · Cross-listed from cs.LG

Beyond Conditional Independence: Root Cause Analysis with Deep Causal Models

Root cause analysis (RCA) is a critical problem in many real-world scenarios. RCA enables the identification of faulty or failing mechanisms in a system by comparing anomalous observations with corresponding reference (i.e., regular) observations. However, existing approaches rely either on heuristic methods or on conditional independence tests with a strong unconfoundedness assumption, and thus fail to exploit other complicated distributional constraints in the presence of latent variables. To relax these assumptions, we model the underlying system as a causal model and the anomalous system as a change in the structural functions of the same causal model. Specifically, to handle unobserved confounders, we establish an implicit connection between distributional constraint testing and root cause analysis. To adapt our approach to data generated from arbitrary causal models, we employ the deep causal model (DCM) framework, in which we design the causal model using neural networks. Finally, we illustrate how our method, RCA-DCM, can utilize different levels of partial graphical knowledge to perform RCA. We evaluate RCA-DCM against state-of-the-art baselines on simulated datasets, a physics-based causal chamber and two micro-service applications. RCA-DCM improves top-1 accuracy over the strongest baseline on both Sock Shop (0.880 vs. 0.752) and Online Boutique (0.776 vs. 0.712), and when the true root cause in the causal chamber is unobserved and acts as a latent confounder, it recovers the exact root-cause set more often than any competing method (perfect recovery rate (PRR) 0.846 vs. 0.731).
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All authors Md Musfiqur Rahman, Kenneth Lee, Ziwei Jiang, Padmaja Jonnalagedda, Ruocheng Guo, Murat Kocaoglu

Machine Learning (Statistics) · Cross-listed from cs.LG

Federated Clustering with Unknown Local and Global Cluster Cardinalities

Federated clustering methods that do not require the global number of clusters $K$ still assume that each client knows its local number $K_g$. This assumption is hard to justify when clients know no more about their data than the server does, as in fault diagnosis across independently operated industrial sites. We propose a two-phase framework in which neither count is known: each client first estimates $K_g$ from its own data, and an aggregator that requires local counts, such as FedGEM, then uses these estimates in place of the true values. For the first phase we introduce Adaptive Split–Merge (ASM), which grows a spherical Gaussian mixture by BIC-driven splitting and then merges excess components. ASM uses no labels, selects its hyperparameters on held-out client data only, and makes no assumption about how clusters are shared across clients. We derive a closed-form split criterion whose critical cluster size falls with anisotropy and rises with dimension, and show empirically that over-fragmentation grows with the number of points per cluster, which federation divides among clients. Across eight datasets, ASM with FedGEM attains a mean ARI of 0.333, against 0.256 for the next best label-free estimator and 0.361 when the true local counts are supplied. It also gives the most reliable global estimates of $K$ and is robust when client size is decoupled from local cardinality.
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All authors Mitushi Goyal, Tarun S., Riddhanya Senapathi, Arun Raman

Statistical Methodology

Measures of Reliability Risk for the Australian Energy Sector

The article identifies the desired properties of the reliability risk metric for the Australian Energy Sector. It proposes a comprehensive set of metrics designed to measure various aspects of the reliability risk when a large portion of power generation is composed of variable renewable energy (VRE). The suggested methods aim to balance the tradeoff between economic benefit and risk management, effectively address the tail risk, and interpret the severity of the outage in a direct way. Properties of the considered reliability metrics are investigated by using simulation studies that use time series of expected unserved energy values. Sample distributions, dependency structures and other statistical properties of the metrics are studied. The results suggest new tools and approaches that can be used to increase the efficiency of the Australian Energy Sector.
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All authors John Boland, Matthias Fresacher, David Hill, Shijia Jin, Ya Li, Graham Mills, Kihun Nam, Craig Oakeshotte, Andriy Olenko

Machine Learning (Statistics) · Cross-listed from math.NA

Into the danger zone: stable extrapolation in high-dimensional function and operator learning

Out-of-distribution (OOD) generalization is a central challenge in scientific machine learning. We study regression problems in which the test distribution differs from the training distribution and ask: under what assumptions on the target function or operator is stable extrapolation possible, and how far beyond the training domain can one extrapolate? Existing theory controls the test error through additive penalties measuring the discrepancy between the training and test distributions. Such guarantees show robustness to small distribution shifts, but can be very pessimistic in comparison to OOD performance observed empirically. We identify classes of holomorphic functions and operators for which the OOD generalization error converges at algebraic rates even in the presence of large distribution shifts. This phenomenon stems from the increasing smoothness of higher-index coordinates, leading to what we term a `blessing of high dimensionality'. For learning with either polynomials, deep neural networks or deep neural operators, we derive explicit rates for arbitrary test measures supported on suitable domains and quantify how the admissible domain depends on the underlying regularity of the function or operator. Our extrapolation guarantees are independent of the test distribution, depending only on its support. We also present a series of numerical experiments across a range of functions and operators that support the main theoretical findings.
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Machine Learning (Statistics) · Cross-listed from cs.LG

When Is Coarse Supervision Worth It? Cost-Aware Learning under Unknown Aggregation

Modern learning systems often acquire supervision at multiple resolutions, trading annotation cost against information content. We study cost-aware two-resolution learning, where expensive fine labels reveal a vector response and cheaper coarse labels reveal a scalar aggregate formed with unknown weights, while the target remains the full response. The challenge is that unknown aggregation changes which directions coarse data can identify, so the value of coarse supervision depends jointly on cost, noise, and identification. We characterize this information geometry and develop an estimate-and-track policy that learns the aggregation rule and tracks the optimal resolution mix. We derive a closed-form break-even condition for coarse supervision and prove that the online policy attains the optimal leading cumulative-risk coefficient, with a matching local asymptotic minimax lower bound. Synthetic experiments support the predicted all-fine/mixed transition, show the online learner approaching the oracle-share benchmark, and demonstrate a finite-budget gain over all-fine acquisition when coarse supervision is sufficiently favorable. Our results provide a principled way to balance information and annotation cost across supervision resolutions.
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All authors Jianyu Xu, Smriti Jha, Aarti Singh, Bryan Wilder

Machine Learning (Statistics) · Cross-listed from cs.LG

Understanding Private Evolution as Learning-Augmented Clustering

Private Evolution (PE) is a differentially private algorithm for synthetic data generation. While it can be viewed as a Wasserstein learning algorithm, it performs much better in practice than worst-case Wasserstein analyses would predict. We recast PE as generative model-augmented Wasserstein learning. We show theoretically that when we take into account the use of a generative model that is able to capture something about the true distribution, then we can obtain much better performance bounds. For example, if the generator gives samples in the same low-dimensional space as the distribution, then sample complexity depends on intrinsic, not ambient, dimension. We also show that standard variants of PE can fail to converge on simple well-clustered instances, and propose a new geometry-aware version of PE with provable convergence on such instances. Experimentally, we show that our new algorithm is competitive with standard baselines and can improve recall.
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Machine Learning (Statistics) · Cross-listed from math.OC

Second-Moment Stochastic Approximation Methods

Classical stochastic approximation methods rely on estimators of the first moment (mean) of a random regression function. We study methods that employ estimators of both the first and the second moments, which include modern deep-learning optimizers such as Adam and Muon as special cases. We derive second-moment stochastic approximation methods through the lens of optimal preconditioning for solving matrix equations, and develop a two-stage framework for their convergence analysis. The first stage focuses on the analysis of conceptual (impractical) methods that rely on the exact first and second moments. In the second stage, we replace the exact moments with their respective estimators, and invoke Dvoretzky's theorem to show that the resulting practical methods converge almost surely to a neighborhood of the target solution. The size of the neighborhood depends on the biases and variances of the first- and second-moment estimators. We derive concrete bounds for Muon and a spectral variant of Adam that determine the radius of their neighborhood of convergence.
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Statistical Methodology

Optimal detection of general moment changes: Simultaneous mean and covariance change detection and beyond

We study multiple change-point detection in multivariate time series whose distributions change in a piecewise constant manner. Distributional changes can manifest across different moment orders, from shifts in the mean and covariance to changes in higher-order moments. Higher-order moments capture increasingly rich distributional features but become difficult to estimate in high dimensions. Our tensor representation unifies moments of different orders within a common linear algebraic framework, enabling a new method to detect changes in moments of all orders up to a prescribed fixed order $p$. The resulting procedure accommodates temporal dependence and allows the dimension of the time series to grow with the sample size. Under suitable regularity conditions, the proposed procedure achieves a localization error rate that matches a newly developed minimax lower bound. We further derive limiting distributions under both nonvanishing and vanishing moment jumps and construct asymptotically valid confidence intervals in the vanishing-jump regime. Numerical experiments and real-data analyses demonstrate the method's effectiveness in detecting moment changes and a range of distributional shifts.
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All authors Xiaokai Luo, Chenghao Xu, Haotian Xu, Carlos Misael Madrid Padilla, Daren Wang

Machine Learning (Statistics)

Hierarchical Utility Calibration for Structured Multiclass Decisions

In multiclass probabilistic prediction, Utility Calibration (UC), which focuses auditing on specified utilities, has recently received attention as a way to guarantee downstream decisions while controlling computational and sample requirements. At the same time, some multiclass problems have meaningful label hierarchies that play important roles in medicine and image classification, yet how UC evaluates utility within a hierarchy remains insufficiently understood. We show that the difference between realized utility and predicted mean utility admits an exact decomposition into a sum of contributions from the internal nodes of the label tree. This decomposition shows that positive and negative contributions from different nodes can cancel, and that even when UC is small, the utility errors remaining in parts of the hierarchy need not be small. To address this problem, we propose Hierarchical Utility Calibration (HUC), which evaluates each node contribution before summation while retaining the same target utility, subgroup, and predicted-utility interval. We further provide finite-sample evaluation over all predicted-utility intervals and propose HUC-Boost, which updates only violated internal nodes, with theoretical guarantees for both.
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Statistics Applications

Geographic Disparities in Hospice Quality and Family Caregiver Experience: The Roles of Ownership, Social Vulnerability, and Workforce Capacity

Hospice quality should be interpreted in relation to both provider organization and the local conditions under which care is delivered. This study develops a provider-county performance assessment framework by linking national Centers for Medicare & Medicaid Services (CMS) hospice data and Consumer Assessment of Healthcare Providers and Systems (CAHPS) Hospice Survey outcomes with county measures of rurality, social vulnerability, health burden, and workforce and health-resource context. The adjusted analysis includes 2,928 providers in 1,078 counties and combines geographic mapping, blockwise regression, six secondary CAHPS outcomes, and eight sensitivity analyses. Adding county context increased adjusted R-squared from 0.077 to 0.202. After full adjustment, for-profit hospices had overall caregiver ratings 3.832 percentage points lower than nonprofit hospices. This negative association appeared across all six secondary CAHPS domains and remained significant in every sensitivity specification. Higher county social vulnerability was also associated with poorer caregiver experience, although its magnitude depended partly on the specification of community health burden. These findings show that county context materially improves hospice performance assessment but does not eliminate the ownership difference. The framework supports context-aware monitoring, peer comparison, and targeted quality improvement.
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Machine Learning (Statistics) · Cross-listed from cs.LG

Optimal Multi-Reward Reinforcement Learning

We study an unknown-transition finite-horizon Markov decision process (MDP) with a finite collection of known reward functions $\{r^1, r^2, \ldots, r^M\}$. The goal is to output an $\epsilon$-optimal policy for every reward using online episodic interaction only. Performance is measured by the policy error $V_{0}^{*, m} - V_{0}^{\widehat\pi^{m}, m}$ where $m\in [M]$ represents the reward function and $V_{0}^{*, m}=\mathbb{E}_{s_1\sim \mu}[V_{1}^{*, m}(s_1)]$. Under this setting, we design a provably efficient algorithm to establish a minimax sample complexity bound of $$ O\left(\frac{SAH^3}{\epsilon^2}\log M \mathrm{polylog}\left(\frac{SAH\log M}{\min\left\{\epsilon, 1\right\}\delta}\right)\right)$$ episodes, with no additional burn-in cost. This matches the information-theoretic lower bound up to a factor of $ \mathrm{polylog}(SAH\log M/(\min\left\{\epsilon, 1\right\}\delta))$. Our method combines three technical ingredients. First, we adapt MVP to reward-switching learning to construct optimistic value estimates. Second, we use fresh replay samples to conservatively evaluate the candidate policies. Third, gap-based multiplicative weights updates adjust the reward-sampling distribution using the differences between these estimates, converting weighted learning progress into simultaneous guarantees for all rewards.
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Monday 28 September

Machine Learning (Statistics)

Memory Prediction Excess: A Probabilistic Quantity for Predictive Gain and Memory Length in Stochastic Processes

A central question in the prediction of stochastic processes is the extent to which past information can improve the probability of correctly predicting the next state. We introduce the Memory Prediction Excess (MPE) to address this question quantitatively. The MPE measures the average improvement in prediction accuracy obtained by using the entire observed history relative to using only the static marginal distribution, in discrete-time finite-state processes. It is defined as the difference between the expected optimal conditional prediction accuracy and the optimal static prediction accuracy. Its basic properties are examined: the MPE is always non-negative; it admits an upper bound depending on the static accuracy, attained if and only if the future is almost surely a deterministic function of the past; and degenerate cases in which the MPE vanishes are characterized. A normalized version, taking values in the unit interval, is introduced as a dimensionless measure of predictive efficiency. A lower bound is derived by comparing predictions based on histories of different lengths, showing that the expected optimal prediction accuracy is monotone with respect to the history length. The framework is extended to finite-length histories, where the finite-history MPE (FH-MPE) measures the predictive gain attainable when only the most recent observations are retained. This leads to the notion of a minimal memory length required to achieve the same predictive performance as the full history. For finite-order Markov chains, this minimal memory length is shown to be bounded by the Markov order. The MPE and its variants are formulated in terms of conditional probabilities and prediction accuracies, offering a probabilistic perspective on the predictive utility of memory that is complementary to classical information-theoretic approaches.
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Machine Learning (Statistics)

LOCO-AdaMP: Built-in LOCO Inference for Adaptive Minipatch Ensembles with Enhanced Prediction

As black-box machine learning models become increasingly common, extracting interpretations with uncertainty quantification has become a critical challenge. One popular type of interpretation is leave-one-covariate-out (LOCO) feature importance, while prior LOCO inference methods often require data-splitting or model-refitting. A recent ensemble framework, LOCO-MP, addresses these challenges using minipatches that subsample both observations and features, but massive feature subsampling can hurt prediction in high-dimensional sparse settings. Motivated by this limitation, we consider minipatch ensembles with adaptive feature sampling guided by LOCO importance, and propose LOCO-AdaMP, which enables free LOCO inference for the resulting adaptive minipatch ensemble. We show that LOCO-AdaMP yields substantially improved predictive models while retaining asymptotically valid feature importance inference without data-splitting, despite the complex dependence between the adaptive sampling distribution and the LOCO importance statistics. Our analysis relies on a careful leave-two-out perturbation bound for the iteratively updated sampling probabilities together with the stability of LOCO scores induced by observation subsampling. Empirical results on synthetic and real datasets demonstrate advantages of LOCO-AdaMP over existing methods in predictive performance, inferential power, and stability. Overall, LOCO-AdaMP provides a flexible ensemble framework (agnostic to base models) that delivers both strong predictive performance and asymptotically valid, powerful feature importance inference for regression.
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Statistical Methodology

Finite-Sample Theory for Fitted Q-Iteration When Actions Are Functions

Offline reinforcement learning seeks optimal decision rules from previously collected data. In some applications, a decision can be an entire function, such as a fluence map in radiation therapy or a smooth movement trajectory in robotics. In this paper, we study the finite-sample theory for fitted Q-iteration (FQI) with functional actions in a discounted infinite-horizon setting. Three major difficulties arise in this setting: first, the absence of a Lebesgue probability density for functional actions complicates coverage descriptions; second, conventional coverage requirements can be restrictive; and third, the large functional action space makes greedy optimization in FQI challenging. To address these difficulties, we study smoothness-regularized policy search under a critic-relative coverage condition. This condition measures how well logged data distinguish relevant action-value differences without requiring an action density. Our main theorem gives finite-sample guarantees for learned-policy regret relative to the best value within a fixed smooth class of functional-action policies. The results allow trajectory lengths to be either bounded or growing and Q-functions to be fitted by either functional-input kernel ridge regression or adaptive functional neural networks. For a few examples, we can obtain polynomially decaying regret bounds in the number of logged transitions, up to logarithmic factors, with logarithmically many FQI iterations. Numerical experiments show gains of learned functional-action policies over constant-action policies and support our adoption of a critic-relative coverage condition.
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Statistical Methodology

Adaptive Sampling of Costly Outcomes in Randomized Clinical Trials

In some randomized trials the primary outcome is costly or slow to measure, while auxiliary variables that predict it are available for everyone. The outcome can then be measured in a probability sample. We study an adaptive design in which the statistician who selects outcomes to measure is blinded to treatment assignment. Outcomes from an initial random sample are used to fit pooled models for the outcome and its residual variance. These set the sampling probabilities for the remaining participants and may be refitted as outcomes accumulate. After unblinding, arm means are estimated by augmented inverse probability weighting. The estimator is unbiased for the complete-data treatment difference for any working models, and a martingale central limit theorem gives Wald intervals under repeated updating. We bound the variance lost by estimating the sampling rule. The bound is linear in the error of the fitted residual variance, quadratic when the optimal probabilities are not truncated, and relates the initial sample size to the learning rate of the models. Relative to designs using treatment assignment, the blinded design loses a term due to unequal residual variances in the two arms and a term due to the conditional treatment effect, which is second order near the null. In simulations, coverage was near nominal. Adaptive sampling was 12% to 34% more efficient than simple random sampling and needed 10% to 26% fewer measured outcomes for the same precision. In a resampling study of an antifungal trial, adaptive sampling reduced the sampling variance by 39%.
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All authors Shuoyang Wang, Wanyu Zhang, Lingli Yang, Kexuan Li

Statistics Applications · Cross-listed from physics.geo-ph

From Wildfire Severity to Snow Persistence: A Multisource GeoAI Study of the 2020 Creek Fire

Accurate prediction of post-fire snow conditions does not necessarily establish how wildfire changed those conditions. We developed an explainable geospatial artificial intelligence framework combining multisource Earth observations, meteorological information, and matched before-after comparisons to examine seasonal snow persistence following the 2020 Creek Fire in California's Sierra Nevada. Harmonized Landsat Sentinel-2 observations were used to estimate the fraction of clear-sky observations containing snow during October-July for eleven water years, 2016-2026, on a 500 m analysis grid. We matched 3,778 snow-zone cells inside the fire perimeter to comparable unburned controls using terrain and pre-fire snow conditions; absolute standardized mean differences after matching were no greater than 0.047. HLS persistence agreed closely with MODIS, with a mean annual spatial correlation of 0.947. The landscape-average before-after control-impact contrast was +0.0017, with a year-level 95% confidence interval of -0.023 to +0.027. A stronger response emerged in the highest burn-severity class, where observed persistence increased by 0.026 relative to matched controls, equivalent to 2.6 percentage points. Under 5 km spatial cross-validation, XGBoost predicted raw post-fire persistence with an out-of-fold coefficient of determination of 0.811, whereas predictive skill for the fire-adjusted anomaly reached 0.046. Elevation and temperature together accounted for 65.7% of mean absolute model attribution. These findings distinguish a severity-associated optical snow response from the terrain-climate relationships that dominate predictive skill. Combining matched comparisons with explainable GeoAI provides a practical framework for forest monitoring that separates accurate environmental mapping from inference about disturbance effects.
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Machine Learning (Statistics) · Cross-listed from cs.LG

Adapting Linear-Time Architectures for Tabular In-Context Learning

Tabular foundation models achieve strong performance by conditioning on labelled examples in context, but softmax attention limits their use on large datasets. Existing linear-time alternatives, however, are mostly causal, and their potential for tabular in-context learning (ICL) remains underexplored. To address this, we (1) revisit causal training setups, (2) compare linear sequence mixers, and (3) investigate their ICL generalisation beyond the pretraining context length. First, we show that the best training setup for causal models resembles next-token prediction. Then, perhaps surprisingly, the most promising linear sequence mixer is causal: DeltaNet outperforms even non-causal linear attention. However, it degrades beyond $2$-$4\times$ the pretraining context length, and existing mitigation strategies such as bidirectionality defer the problem at best. A hidden-state oracle shows that this is not a capacity problem. Instead, our analysis points to an instability in the recurrent state, which drifts in deeper layers of causal models. Since DeltaNet's learned write rates overfit to the pretraining regime, we modulate them with a time-dependent decay schedule intervention to stabilise length generalisation. Finally, re-introducing non-causality by reading out from the final state allows us to closely match a controlled softmax attention baseline on OpenML-CC18 and TabArena.
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All authors David Schnurr, Felix Sarnthein, Thomas Hofmann, Imanol Schlag

Statistics Applications

Multilevel regression trees with application to wildfires in the American west

We propose a Bayesian regression tree model fit within a multilevel structure and apply it to historic wildfire data in the western United States. Sharing of information between related groups (ecoregions) combined with highly interpretable regression trees allows for better predictions and understanding of climate and land cover variables predictive of wildfires. By doing a simulation study with a range of performance metrics, we demonstrate our method produces tree posteriors most structurally similar to assumed true trees, while simultaneously achieving good out-of-sample predictive performance. Applied to a large wildfire data set, we explore variable splits within regression trees corresponding to each ecoregion in detail, taking into account known features of each location. Shared hyperparameters between trees provide highly useful understanding of both variable and split value importance in predicting wildfires among all ecoregions, with no direct parallel in comparable models. Namely, we highlight potential evaporation, temperature, and evergreen forest land cover as variables most associated with historic wildfires, with some observable patterns in split values most commonly chosen across the groups. We propose a new algorithm based on parallel tempering, conditioning on shared hyperparameters at the true posterior temperature, improving Markov chain mixing, a known bottleneck in Bayesian CART models.
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Statistical Methodology

MCMC-Free Uncertainty Quantification for Deep Generative Inference for Spatially Varying Coefficient Models at Scale

Varying coefficient (VC) regression models have become indispensable tools in spatial data analysis, providing unmatched flexibility in capturing complex, nonlinear relationships and spatially-varying effects of predictors on responses. Although hierarchical Bayesian approaches offer a rigorous probabilistic framework for uncertainty quantification in VC modeling, their practical application to large-scale spatial datasets remains severely hindered by the scalability limitations of Markov chain Monte Carlo (MCMC) algorithms. In response, the past decade has seen substantial advances in developing more efficient hierarchical Bayesian VC models, primarily through substituting traditional Gaussian processes (GP) with computationally efficient stochastic surrogates for estimating unknown coefficient functions. This article introduces a fundamentally different approach: the Geostatistical Variational Auto-Encoder (GeoVAE), a hierarchical deep generative framework built specifically for joint estimation of multiple spatially varying coefficient functions. GeoVAE departs from both classical GP-based Bayesian models and standard variational auto-encoders (VAEs) in two key ways. First, it constructs a coefficient-specific auto-encoder for each coefficient function, allowing each to capture its own spatial resolution and smoothness. Second, a hierarchical synthesis layer integrates information across these auto-encoders to a shared auto-encoder, explicitly modeling cross-coefficient dependencies arising from the shared spatial domain. This design enables GeoVAE to recover complex spatial patterns at computational cost that scales favorably with sample size, without MCMC or explicit GP covariance representations. We characterize the advantages and limitations of GeoVAE relative to hierarchical Bayesian spatial models, demonstrating its strong potential for large-scale spatial analysis.
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Statistical Methodology

Faster Estimates from Binned Test Score Data—and How Accurate They Are

Education agencies often summarize test score distributions by counting how many students scored in 3 to 5 different bins. The HETOP model transforms bin counts into estimated means and standard deviations, assuming that scores follow a normal distribution within each school or district. Past HETOP implementations ran slowly, taking 3–60 minutes, if they finished, when given bin counts for all 1,151 districts in Texas. Our new function, \code{fast\_hetop()} in the R package \pkg{binest}, runs all Texas districts in less than a second. Users can choose between maximum likelihood, empirical Bayes, sample-based or population-based estimates. Estimates are strongly correlated with true values, but have bias when the score distribution is skewed and scores are concentrated in the lowest or highest bin.
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