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Deep neural networks have become essential for numerous applications due to their strong empirical performance such as vision, RL, and classification. Unfortunately, these networks are quite difficult to interpret, and this limits their…

Machine Learning · Computer Science 2021-10-12 Sina Alemohammad , Hossein Babaei , CJ Barberan , Naiming Liu , Lorenzo Luzi , Blake Mason , Richard G. Baraniuk

Learning expressive kernels while retaining tractable inference remains a central challenge in scaling Gaussian processes (GPs) to large and complex datasets. We propose a scalable GP regressor based on deep basis kernels (DBKs). Our DBK is…

Machine Learning · Statistics 2026-02-05 Yunqin Zhu , Henry Shaowu Yuchi , Yao Xie

Modern machine learning systems based on neural networks have shown great success in learning complex data patterns while being able to make good predictions on unseen data points. However, the limited interpretability of these systems…

Machine Learning · Computer Science 2020-07-22 Sarath Shekkizhar , Antonio Ortega

Recent works have partly attributed the generalization ability of over-parameterized neural networks to frequency bias -- networks trained with gradient descent on data drawn from a uniform distribution find a low frequency fit before high…

Machine Learning · Computer Science 2020-03-11 Ronen Basri , Meirav Galun , Amnon Geifman , David Jacobs , Yoni Kasten , Shira Kritchman

Physics-informed neural networks (PINNs) are demonstrating remarkable promise in integrating physical models with gappy and noisy observational data, but they still struggle in cases where the target functions to be approximated exhibit…

Machine Learning · Computer Science 2021-06-16 Sifan Wang , Hanwen Wang , Paris Perdikaris

A recent series of theoretical works showed that the dynamics of neural networks with a certain initialisation are well-captured by kernel methods. Concurrent empirical work demonstrated that kernel methods can come close to the performance…

Machine Learning · Computer Science 2021-06-11 Maria Refinetti , Sebastian Goldt , Florent Krzakala , Lenka Zdeborová

We prove large and moderate deviations for the output of Gaussian fully connected neural networks. The main achievements concern deep neural networks (i.e., when the model has more than one hidden layer) and hold for bounded and continuous…

Probability · Mathematics 2026-04-01 Claudio Macci , Barbara Pacchiarotti , Giovanni Luca Torrisi

Deep generative models are increasingly used for molecular discovery, with most recent approaches relying on equivariant graph neural networks (GNNs) under the assumption that explicit equivariance is essential for generating high-quality…

Machine Learning · Computer Science 2025-07-15 Ewa M. Nowara , Joshua Rackers , Patricia Suriana , Pan Kessel , Max Shen , Andrew Martin Watkins , Michael Maser

Scaling laws offer valuable insights into the relationship between neural network performance and computational cost, yet their underlying mechanisms remain poorly understood. In this work, we empirically analyze how neural networks behave…

Machine Learning · Computer Science 2025-07-08 Konstantin Nikolaou , Sven Krippendorf , Samuel Tovey , Christian Holm

Deep neural networks have revolutionized machine learning, yet their training dynamics remain theoretically unclear-we develop a continuous-time, matrix-valued stochastic differential equation (SDE) framework that rigorously connects the…

Machine Learning · Computer Science 2026-02-10 Brian Richard Olsen , Sam Fatehmanesh , Frank Xiao , Adarsh Kumarappan , Anirudh Gajula

In this paper, we investigate a two-layer fully connected neural network of the form $f(X)=\frac{1}{\sqrt{d_1}}\boldsymbol{a}^\top \sigma\left(WX\right)$, where $X\in\mathbb{R}^{d_0\times n}$ is a deterministic data matrix,…

Statistics Theory · Mathematics 2023-04-17 Zhichao Wang , Yizhe Zhu

Self-explaining models are models that reveal decision making parameters in an interpretable manner so that the model reasoning process can be directly understood by human beings. General Linear Models (GLMs) are self-explaining because the…

Machine Learning · Computer Science 2019-05-31 Yingjing Lu , Runde Yang

The overparameterization of variational quantum circuits, as a model of Quantum Neural Networks (QNN), not only improves their trainability but also serves as a method for evaluating the property of a given ansatz by investigating their…

Quantum Physics · Physics 2023-05-23 Ali Rad

The Neural Tangent Kernel (NTK) has recently attracted intense study, as it describes the evolution of an over-parameterized Neural Network (NN) trained by gradient descent. However, it is now well-known that gradient descent is not always…

Machine Learning · Computer Science 2021-03-23 Lei Tan , Shutong Wu , Xiaolin Huang

Deep neural networks come in many sizes and architectures. The choice of architecture, in conjunction with the dataset and learning algorithm, is commonly understood to affect the learned neural representations. Yet, recent results have…

Machine Learning · Computer Science 2024-07-08 Loek van Rossem , Andrew M. Saxe

Analyzing neural network dynamics via stochastic gradient descent (SGD) is crucial to building theoretical foundations for deep learning. Previous work has analyzed structured inputs within the \textit{hidden manifold model}, often under…

Machine Learning · Statistics 2025-12-01 Jaeyong Bae , Hawoong Jeong

Recent neural IR models have demonstrated deep learning's utility in ad-hoc information retrieval. However, deep models have a reputation for being black boxes, and the roles of a neural IR model's components may not be obvious at first…

Information Retrieval · Computer Science 2017-07-25 Andrew Yates , Kai Hui

While graph kernels (GKs) are easy to train and enjoy provable theoretical guarantees, their practical performances are limited by their expressive power, as the kernel function often depends on hand-crafted combinatorial features of…

Machine Learning · Computer Science 2019-11-05 Simon S. Du , Kangcheng Hou , Barnabás Póczos , Ruslan Salakhutdinov , Ruosong Wang , Keyulu Xu

In suitably initialized wide networks, small learning rates transform deep neural networks (DNNs) into neural tangent kernel (NTK) machines, whose training dynamics is well-approximated by a linear weight expansion of the network at…

Machine Learning · Computer Science 2020-10-29 Stanislav Fort , Gintare Karolina Dziugaite , Mansheej Paul , Sepideh Kharaghani , Daniel M. Roy , Surya Ganguli

In this article, we review the literature on statistical theories of neural networks from three perspectives: approximation, training dynamics and generative models. In the first part, results on excess risks for neural networks are…

Machine Learning · Statistics 2024-09-17 Namjoon Suh , Guang Cheng