perturbation
Separating Geometry from Probability in the Analysis of Generalization
Raginsky, Maxim, Recht, Benjamin
The goal of machine learning is to find models that minimize prediction error on data that has not yet been seen. Its operational paradigm assumes access to a dataset $S$ and articulates a scheme for evaluating how well a given model performs on an arbitrary sample. The sample can be $S$ (in which case we speak of ``in-sample'' performance) or some entirely new $S'$ (in which case we speak of ``out-of-sample'' performance). Traditional analysis of generalization assumes that both in- and out-of-sample data are i.i.d.\ draws from an infinite population. However, these probabilistic assumptions cannot be verified even in principle. This paper presents an alternative view of generalization through the lens of sensitivity analysis of solutions of optimization problems to perturbations in the problem data. Under this framework, generalization bounds are obtained by purely deterministic means and take the form of variational principles that relate in-sample and out-of-sample evaluations through an error term that quantifies how close out-of-sample data are to in-sample data. Statistical assumptions can then be used \textit{ex post} to characterize the situations when this error term is small (either on average or with high probability).
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Random Matrix Theory of Early-Stopped Gradient Flow: A Transient BBP Scenario
Coeurdoux, Florentin, Ferré, Grégoire, Bouchaud, Jean-Philippe
Empirical studies of trained models often report a transient regime in which signal is detectable in a finite gradient descent time window before overfitting dominates. We provide an analytically tractable random-matrix model that reproduces this phenomenon for gradient flow in a linear teacher--student setting. In this framework, learning occurs when an isolated eigenvalue separates from a noisy bulk, before eventually disappearing in the overfitting regime. The key ingredient is anisotropy in the input covariance, which induces fast and slow directions in the learning dynamics. In a two-block covariance model, we derive the full time-dependent bulk spectrum of the symmetrized weight matrix through a $2\times 2$ Dyson equation, and we obtain an explicit outlier condition for a rank-one teacher via a rank-two determinant formula. This yields a transient Baik-Ben Arous-Péché (BBP) transition: depending on signal strength and covariance anisotropy, the teacher spike may never emerge, emerge and persist, or emerge only during an intermediate time interval before being reabsorbed into the bulk. We map the corresponding phase diagrams and validate the theory against finite-size simulations. Our results provide a minimal solvable mechanism for early stopping as a transient spectral effect driven by anisotropy and noise.
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Towards Verified and Targeted Explanations through Formal Methods
Wang, Hanchen David, Lopez, Diego Manzanas, Robinette, Preston K., Oguz, Ipek, Johnson, Taylor T., Ma, Meiyi
As deep neural networks are deployed in safety-critical domains such as autonomous driving and medical diagnosis, stakeholders need explanations that are interpretable but also trustworthy with formal guarantees. Existing XAI methods fall short: heuristic attribution techniques (e.g., LIME, Integrated Gradients) highlight influential features but offer no mathematical guarantees about decision boundaries, while formal methods verify robustness yet remain untargeted, analyzing the nearest boundary regardless of whether it represents a critical risk. In safety-critical systems, not all misclassifications carry equal consequences; confusing a "Stop" sign for a "60 kph" sign is far more dangerous than confusing it with a "No Passing" sign. We introduce ViTaX (Verified and Targeted Explanations), a formal XAI framework that generates targeted semifactual explanations with mathematical guarantees. For a given input (class y) and a user-specified critical alternative (class t), ViTaX: (1) identifies the minimal feature subset most sensitive to the y->t transition, and (2) applies formal reachability analysis to guarantee that perturbing these features by epsilon cannot flip the classification to t. We formalize this through Targeted epsilon-Robustness, certifying whether a feature subset remains robust under perturbation toward a specific target class. ViTaX is the first method to provide formally guaranteed explanations of a model's resilience against user-identified alternatives. Evaluations on MNIST, GTSRB, EMNIST, and TaxiNet demonstrate over 30% fidelity improvement with minimal explanation cardinality.
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Lipschitz regularity in Flow Matching and Diffusion Models: sharp sampling rates and functional inequalities
Under general assumptions on the target distribution $p^\star$, we establish a sharp Lipschitz regularity theory for flow-matching vector fields and diffusion-model scores, with optimal dependence on time and dimension. As applications, we obtain Wasserstein discretization bounds for Euler-type samplers in dimension $d$: with $N$ discretization steps, the error achieves the optimal rate $\sqrt{d}/N$ up to logarithmic factors. Moreover, the constants do not deteriorate exponentially with the spatial extent of $p^\star$. We also show that the one-sided Lipschitz control yields a globally Lipschitz transport map from the standard Gaussian to $p^\star$, which implies Poincaré and log-Sobolev inequalities for a broad class of probability measures.
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Noisy Nonreciprocal Pairwise Comparisons: Scale Variation, Noise Calibration, and Admissible Ranking Regions
Pairwise comparisons are widely used in decision analysis, preference modeling, and evaluation problems. In many practical situations, the observed comparison matrix is not reciprocal. This lack of reciprocity is often treated as a defect to be corrected immediately. In this article, we adopt a different point of view: part of the nonreciprocity may reflect a genuine variation in the evaluation scale, while another part is due to random perturbations. We introduce an additive model in which the unknown underlying comparison matrix is consistent but not necessarily reciprocal. The reciprocal component carries the global ranking information, whereas the symmetric component describes possible scale variation. Around this structured matrix, we add a random perturbation and show how to estimate the noise level, assess whether the scale variation remains moderate, and assign probabilities to admissible ranking regions in the sense of strict ranking by pairwise comparisons. We also compare this approach with the brutal projection onto reciprocal matrices, which suppresses all symmetric information at once. The Gaussian perturbation model is used here not because human decisions are exactly Gaussian, but because observed judgment errors often result from the accumulation of many small effects. In such a context, the central limit principle provides a natural heuristic justification for Gaussian noise. This makes it possible to derive explicit estimators and probability assessments while keeping the model interpretable for decision problems.
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Privacy-Accuracy Trade-offs in High-Dimensional LASSO under Perturbation Mechanisms
Sakata, Ayaka, Tanzawa, Haruka
We study privacy-preserving sparse linear regression in the high-dimensional regime, focusing on the LASSO estimator. We analyze two widely used mechanisms for differential privacy: output perturbation, which injects noise into the estimator, and objective perturbation, which adds a random linear term to the loss function. Using approximate message passing (AMP), we characterize the typical behavior of these estimators under random design and privacy noise. To quantify privacy, we adopt typical-case measures, including the on-average KL divergence, which admits a hypothesis-testing interpretation in terms of distinguishability between neighboring datasets. Our analysis reveals that sparsity plays a central role in shaping the privacy-accuracy trade-off: stronger regularization can improve privacy by stabilizing the estimator against single-point data changes. We further show that the two mechanisms exhibit qualitatively different behaviors. In particular, for objective perturbation, increasing the noise level can have non-monotonic effects, and excessive noise may destabilize the estimator, leading to increased sensitivity to data perturbations. Our results demonstrate that AMP provides a powerful framework for analyzing privacy-accuracy trade-offs in high-dimensional sparse models.
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A PAC-Bayesian approach to generalization for quantum models
Rodriguez-Grasa, Pablo, Caro, Matthias C., Eisert, Jens, Gil-Fuster, Elies, Schreiber, Franz J., Bravo-Prieto, Carlos
Generalization is a central concept in machine learning theory, yet for quantum models, it is predominantly analyzed through uniform bounds that depend on a model's overall capacity rather than the specific function learned. These capacity-based uniform bounds are often too loose and entirely insensitive to the actual training and learning process. Previous theoretical guarantees have failed to provide non-uniform, data-dependent bounds that reflect the specific properties of the learned solution rather than the worst-case behavior of the entire hypothesis class. To address this limitation, we derive the first PAC-Bayesian generalization bounds for a broad class of quantum models by analyzing layered circuits composed of general quantum channels, which include dissipative operations such as mid-circuit measurements and feedforward. Through a channel perturbation analysis, we establish non-uniform bounds that depend on the norms of learned parameter matrices; we extend these results to symmetry-constrained equivariant quantum models; and we validate our theoretical framework with numerical experiments. This work provides actionable model design insights and establishes a foundational tool for a more nuanced understanding of generalization in quantum machine learning.
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Informative Perturbation Selection for Uncertainty-Aware Post-hoc Explanations
Chugh, Sumedha, Prasad, Ranjitha, Shah, Nazreen
Trust and ethical concerns due to the widespread deployment of opaque machine learning (ML) models motivating the need for reliable model explanations. Post-hoc model-agnostic explanation methods addresses this challenge by learning a surrogate model that approximates the behavior of the deployed black-box ML model in the locality of a sample of interest. In post-hoc scenarios, neither the underlying model parameters nor the training are available, and hence, this local neighborhood must be constructed by generating perturbed inputs in the neighborhood of the sample of interest, and its corresponding model predictions. We propose \emph{Expected Active Gain for Local Explanations} (\texttt{EAGLE}), a post-hoc model-agnostic explanation framework that formulates perturbation selection as an information-theoretic active learning problem. By adaptively sampling perturbations that maximize the expected information gain, \texttt{EAGLE} efficiently learns a linear surrogate explainable model while producing feature importance scores along with the uncertainty/confidence estimates. Theoretically, we establish that cumulative information gain scales as $\mathcal{O}(d \log t)$, where $d$ is the feature dimension and $t$ represents the number of samples, and that the sample complexity grows linearly with $d$ and logarithmically with the confidence parameter $1/δ$. Empirical results on tabular and image datasets corroborate our theoretical findings and demonstrate that \texttt{EAGLE} improves explanation reproducibility across runs, achieves higher neighborhood stability, and improves perturbation sample quality as compared to state-of-the-art baselines such as Tilia, US-LIME, GLIME and BayesLIME.
Lower bounds on the robustness to adversarial perturbations
The input-output mappings learned by state-of-the-art neural networks are significantly discontinuous. It is possible to cause a neural network used for image recognition to misclassify its input by applying very specific, hardly perceptible perturbations to the input, called adversarial perturbations. Many hypotheses have been proposed to explain the existence of these peculiar samples as well as several methods to mitigate them. A proven explanation remains elusive, however. In this work, we take steps towards a formal characterization of adversarial perturbations by deriving lower bounds on the magnitudes of perturbations necessary to change the classification of neural networks. The bounds are experimentally verified on the MNIST and CIFAR-10 data sets.
Adversarially Robust Generalization Requires More Data
Machine learning models are often susceptible to adversarial perturbations of their inputs. Even small perturbations can cause state-of-the-art classifiers with high standard accuracy to produce an incorrect prediction with high confidence. To better understand this phenomenon, we study adversarially robust learning from the viewpoint of generalization. We show that already in a simple natural data model, the sample complexity of robust learning can be significantly larger than that of standard learning. This gap is information theoretic and holds irrespective of the training algorithm or the model family. We complement our theoretical results with experiments on popular image classification datasets and show that a similar gap exists here as well. We postulate that the difficulty of training robust classifiers stems, at least partially, from this inherently larger sample complexity.