ITMay 5
Fast One-Pass Sparse Approximation of the Top Eigenvectors of Huge Approximately Low-Rank Matrices? Yes, $MAM^*$!Edem Boahen, Simone Brugiapaglia, Hung-Hsu Chou et al.
Motivated by applications such as sparse PCA, in this paper we present provably-accurate one-pass algorithms for the sparse approximation of the top eigenvectors of extremely massive matrices based on a single compact linear sketch. The resulting compressive-sensing-based approaches can approximate the leading eigenvectors of huge approximately low-rank matrices that are too large to store in memory based on a single pass over its entries while utilizing a total memory footprint on the order of the much smaller desired sparse eigenvector approximations. Finally, the compressive sensing recovery algorithm itself (which takes the gathered compressive matrix measurements as input, and then outputs sparse approximations of its top eigenvectors) can also be formulated to run in a time which principally depends on the size of the sought sparse approximations, making its runtime sublinear in the size of the large matrix whose eigenvectors one aims to approximate. Preliminary experiments on huge matrices having $\sim 10^{16}$ entries illustrate the developed theory and demonstrate the practical potential of the proposed approach.
OCMay 27
Implicit Regularization in Perturbed Deep Matrix Factorization: Spectral Conditions and StabilityJingzhe Wang, Hung-Hsu Chou
This paper studies the stability of low-rank implicit regularization in perturbed deep matrix factorization, where the target matrix is corrupted by a noise matrix. We first derive sufficient spectral conditions under which gradient descent exhibits a low-rank phase in the noiseless setting. These conditions show how the target spectrum, initialization, and step size jointly determine the existence of a nonempty low-rank interval. We then analyze the perturbed gradient descent dynamics, proving convergence guarantees and quantifying how the perturbation affects iteration complexity and eigenvalue recovery. Finally, we show that the low-rank phase persists under perturbation, with explicit dependence on the perturbation size. Numerical experiments support the theoretical findings.
LGFeb 5
Latent Structure Emergence in Diffusion Models via Confidence-Based FilteringWei Wei, Yizhou Zeng, Kuntian Chen et al.
Diffusion models rely on a high-dimensional latent space of initial noise seeds, yet it remains unclear whether this space contains sufficient structure to predict properties of the generated samples, such as their classes. In this work, we investigate the emergence of latent structure through the lens of confidence scores assigned by a pre-trained classifier to generated samples. We show that while the latent space appears largely unstructured when considering all noise realizations, restricting attention to initial noise seeds that produce high-confidence samples reveals pronounced class separability. By comparing class predictability across noise subsets of varying confidence and examining the class separability of the latent space, we find evidence of class-relevant latent structure that becomes observable only under confidence-based filtering. As a practical implication, we discuss how confidence-based filtering enables conditional generation as an alternative to guidance-based methods.
LGMay 27, 2025
Conflicting Biases at the Edge of Stability: Norm versus Sharpness RegularizationVit Fojtik, Maria Matveev, Hung-Hsu Chou et al.
A widely believed explanation for the remarkable generalization capacities of overparameterized neural networks is that the optimization algorithms used for training induce an implicit bias towards benign solutions. To grasp this theoretically, recent works examine gradient descent and its variants in simplified training settings, often assuming vanishing learning rates. These studies reveal various forms of implicit regularization, such as $\ell_1$-norm minimizing parameters in regression and max-margin solutions in classification. Concurrently, empirical findings show that moderate to large learning rates exceeding standard stability thresholds lead to faster, albeit oscillatory, convergence in the so-called Edge-of-Stability regime, and induce an implicit bias towards minima of low sharpness (norm of training loss Hessian). In this work, we argue that a comprehensive understanding of the generalization performance of gradient descent requires analyzing the interaction between these various forms of implicit regularization. We empirically demonstrate that the learning rate balances between low parameter norm and low sharpness of the trained model. We furthermore prove for diagonal linear networks trained on a simple regression task that neither implicit bias alone minimizes the generalization error. These findings demonstrate that focusing on a single implicit bias is insufficient to explain good generalization, and they motivate a broader view of implicit regularization that captures the dynamic trade-off between norm and sharpness induced by non-negligible learning rates.
LGMay 21, 2025
GradPCA: Leveraging NTK Alignment for Reliable Out-of-Distribution DetectionMariia Seleznova, Hung-Hsu Chou, Claudio Mayrink Verdun et al.
We introduce GradPCA, an Out-of-Distribution (OOD) detection method that exploits the low-rank structure of neural network gradients induced by Neural Tangent Kernel (NTK) alignment. GradPCA applies Principal Component Analysis (PCA) to gradient class-means, achieving more consistent performance than existing methods across standard image classification benchmarks. We provide a theoretical perspective on spectral OOD detection in neural networks to support GradPCA, highlighting feature-space properties that enable effective detection and naturally emerge from NTK alignment. Our analysis further reveals that feature quality -- particularly the use of pretrained versus non-pretrained representations -- plays a crucial role in determining which detectors will succeed. Extensive experiments validate the strong performance of GradPCA, and our theoretical framework offers guidance for designing more principled spectral OOD detectors.
LGMay 25, 2023
Neural (Tangent Kernel) CollapseMariia Seleznova, Dana Weitzner, Raja Giryes et al.
This work bridges two important concepts: the Neural Tangent Kernel (NTK), which captures the evolution of deep neural networks (DNNs) during training, and the Neural Collapse (NC) phenomenon, which refers to the emergence of symmetry and structure in the last-layer features of well-trained classification DNNs. We adopt the natural assumption that the empirical NTK develops a block structure aligned with the class labels, i.e., samples within the same class have stronger correlations than samples from different classes. Under this assumption, we derive the dynamics of DNNs trained with mean squared (MSE) loss and break them into interpretable phases. Moreover, we identify an invariant that captures the essence of the dynamics, and use it to prove the emergence of NC in DNNs with block-structured NTK. We provide large-scale numerical experiments on three common DNN architectures and three benchmark datasets to support our theory.
LGMay 9, 2023
Robust Implicit Regularization via Weight NormalizationHung-Hsu Chou, Holger Rauhut, Rachel Ward
Overparameterized models may have many interpolating solutions; implicit regularization refers to the hidden preference of a particular optimization method towards a certain interpolating solution among the many. A by now established line of work has shown that (stochastic) gradient descent tends to have an implicit bias towards low rank and/or sparse solutions when used to train deep linear networks, explaining to some extent why overparameterized neural network models trained by gradient descent tend to have good generalization performance in practice. However, existing theory for square-loss objectives often requires very small initialization of the trainable weights, which is at odds with the larger scale at which weights are initialized in practice for faster convergence and better generalization performance. In this paper, we aim to close this gap by incorporating and analyzing gradient flow (continuous-time version of gradient descent) with weight normalization, where the weight vector is reparameterized in terms of polar coordinates, and gradient flow is applied to the polar coordinates. By analyzing key invariants of the gradient flow and using Lojasiewicz Theorem, we show that weight normalization also has an implicit bias towards sparse solutions in the diagonal linear model, but that in contrast to plain gradient flow, weight normalization enables a robust bias that persists even if the weights are initialized at practically large scale. Experiments suggest that the gains in both convergence speed and robustness of the implicit bias are improved dramatically by using weight normalization in overparameterized diagonal linear network models.
OCDec 21, 2021
More is Less: Inducing Sparsity via OverparameterizationHung-Hsu Chou, Johannes Maly, Holger Rauhut
In deep learning it is common to overparameterize neural networks, that is, to use more parameters than training samples. Quite surprisingly training the neural network via (stochastic) gradient descent leads to models that generalize very well, while classical statistics would suggest overfitting. In order to gain understanding of this implicit bias phenomenon we study the special case of sparse recovery (compressed sensing) which is of interest on its own. More precisely, in order to reconstruct a vector from underdetermined linear measurements, we introduce a corresponding overparameterized square loss functional, where the vector to be reconstructed is deeply factorized into several vectors. We show that, if there exists an exact solution, vanilla gradient flow for the overparameterized loss functional converges to a good approximation of the solution of minimal $\ell_1$-norm. The latter is well-known to promote sparse solutions. As a by-product, our results significantly improve the sample complexity for compressed sensing via gradient flow/descent on overparameterized models derived in previous works. The theory accurately predicts the recovery rate in numerical experiments. Our proof relies on analyzing a certain Bregman divergence of the flow. This bypasses the obstacles caused by non-convexity and should be of independent interest.
LGNov 27, 2020
Gradient Descent for Deep Matrix Factorization: Dynamics and Implicit Bias towards Low RankHung-Hsu Chou, Carsten Gieshoff, Johannes Maly et al.
In deep learning, it is common to use more network parameters than training points. In such scenarioof over-parameterization, there are usually multiple networks that achieve zero training error so that thetraining algorithm induces an implicit bias on the computed solution. In practice, (stochastic) gradientdescent tends to prefer solutions which generalize well, which provides a possible explanation of thesuccess of deep learning. In this paper we analyze the dynamics of gradient descent in the simplifiedsetting of linear networks and of an estimation problem. Although we are not in an overparameterizedscenario, our analysis nevertheless provides insights into the phenomenon of implicit bias. In fact, wederive a rigorous analysis of the dynamics of vanilla gradient descent, and characterize the dynamicalconvergence of the spectrum. We are able to accurately locate time intervals where the effective rankof the iterates is close to the effective rank of a low-rank projection of the ground-truth matrix. Inpractice, those intervals can be used as criteria for early stopping if a certain regularity is desired. Wealso provide empirical evidence for implicit bias in more general scenarios, such as matrix sensing andrandom initialization. This suggests that deep learning prefers trajectories whose complexity (measuredin terms of effective rank) is monotonically increasing, which we believe is a fundamental concept for thetheoretical understanding of deep learning.
LGJun 15, 2020
Overparameterization and generalization error: weighted trigonometric interpolationYuege Xie, Hung-Hsu Chou, Holger Rauhut et al.
Motivated by surprisingly good generalization properties of learned deep neural networks in overparameterized scenarios and by the related double descent phenomenon, this paper analyzes the relation between smoothness and low generalization error in an overparameterized linear learning problem. We study a random Fourier series model, where the task is to estimate the unknown Fourier coefficients from equidistant samples. We derive exact expressions for the generalization error of both plain and weighted least squares estimators. We show precisely how a bias towards smooth interpolants, in the form of weighted trigonometric interpolation, can lead to smaller generalization error in the overparameterized regime compared to the underparameterized regime. This provides insight into the power of overparameterization, which is common in modern machine learning.