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Deep neural networks (DNNs) often produce overconfident out-of-distribution predictions, motivating Bayesian uncertainty quantification. The Linearized Laplace Approximation (LLA) achieves this by linearizing the DNN and applying Laplace…

Machine Learning · Statistics 2026-02-04 Pedro Jiménez , Luis A. Ortega , Pablo Morales-Álvarez , Daniel Hernández-Lobato

Laplace approximation (LA) and its linearized variant (LLA) enable effortless adaptation of pretrained deep neural networks to Bayesian neural networks. The generalized Gauss-Newton (GGN) approximation is typically introduced to improve…

Machine Learning · Computer Science 2022-10-25 Zhijie Deng , Feng Zhou , Jun Zhu

The Linearized Laplace Approximation (LLA) has been recently used to perform uncertainty estimation on the predictions of pre-trained deep neural networks (DNNs). However, its widespread application is hindered by significant computational…

Machine Learning · Statistics 2024-05-24 Luis A. Ortega , Simón Rodríguez Santana , Daniel Hernández-Lobato

Despite their immense promise in performing a variety of learning tasks, a theoretical understanding of the limitations of Deep Neural Networks (DNNs) has so far eluded practitioners. This is partly due to the inability to determine the…

Machine Learning · Computer Science 2024-01-25 Saad Qadeer , Andrew Engel , Amanda Howard , Adam Tsou , Max Vargas , Panos Stinis , Tony Chiang

Selecting hyperparameters in deep learning greatly impacts its effectiveness but requires manual effort and expertise. Recent works show that Bayesian model selection with Laplace approximations can allow to optimize such hyperparameters…

The linearized-Laplace approximation (LLA) has been shown to be effective and efficient in constructing Bayesian neural networks. It is theoretically compelling since it can be seen as a Gaussian process posterior with the mean function…

Machine Learning · Computer Science 2023-07-13 Agustinus Kristiadi , Alexander Immer , Runa Eschenhagen , Vincent Fortuin

The Laplace approximation provides a scalable and efficient means of quantifying weight-space uncertainty in deep neural networks, enabling the application of Bayesian tools such as predictive uncertainty and model selection via Occam's…

Machine Learning · Computer Science 2025-07-24 Tobias Weber , Bálint Mucsányi , Lenard Rommel , Thomas Christie , Lars Kasüschke , Marvin Pförtner , Philipp Hennig

A recent trend in explainable AI research has focused on surrogate modeling, where neural networks are approximated as simpler ML algorithms such as kernel machines. A second trend has been to utilize kernel functions in various…

Machine Learning · Computer Science 2024-03-13 Andrew Engel , Zhichao Wang , Natalie S. Frank , Ioana Dumitriu , Sutanay Choudhury , Anand Sarwate , Tony Chiang

To reduce training costs, several Deep neural networks (DNNs) that can learn from a small set of HF data and a sufficient number of low-fidelity (LF) data have been proposed. In these established neural networks, a parallel structure is…

Computational Physics · Physics 2024-05-08 Zhihui Li , Francesco Montomoli

We introduce the concept of scalable neural network kernels (SNNKs), the replacements of regular feedforward layers (FFLs), capable of approximating the latter, but with favorable computational properties. SNNKs effectively disentangle the…

Machine Learning · Computer Science 2024-03-07 Arijit Sehanobish , Krzysztof Choromanski , Yunfan Zhao , Avinava Dubey , Valerii Likhosherstov

In this paper, we leverage a recent deep kernel representer theorem to connect kernel based learning and (deep) neural networks in order to understand their interplay. In particular, we show that the use of special types of kernels yields…

Machine Learning · Computer Science 2025-09-19 Tizian Wenzel , Gabriele Santin , Bernard Haasdonk

Latent Dirichlet Allocation (LDA) is a three-level hierarchical Bayesian model for topic inference. In spite of its great success, inferring the latent topic distribution with LDA is time-consuming. Motivated by the transfer learning…

Machine Learning · Computer Science 2015-08-06 Dongxu Zhang , Tianyi Luo , Dong Wang , Rong Liu

Jacobian-Enhanced Neural Networks (JENN) are densely connected multi-layer perceptrons, whose training process is modified to predict partial derivatives accurately. Their main benefit is better accuracy with fewer training points compared…

Machine Learning · Computer Science 2026-01-01 Steven H. Berguin

The performance of the data-dependent neural tangent kernel (NTK; Jacot et al. (2018)) associated with a trained deep neural network (DNN) often matches or exceeds that of the full network. This implies that DNN training via gradient…

Machine Learning · Computer Science 2025-05-22 Johannes Schwab , Bryan Kelly , Semyon Malamud , Teng Andrea Xu

Deep kernel learning (DKL) leverages the connection between Gaussian process (GP) and neural networks (NN) to build an end-to-end, hybrid model. It combines the capability of NN to learn rich representations under massive data and the…

Machine Learning · Statistics 2020-08-20 Haitao Liu , Yew-Soon Ong , Xiaomo Jiang , Xiaofang Wang

Data augmentation is commonly applied to improve performance of deep learning by enforcing the knowledge that certain transformations on the input preserve the output. Currently, the data augmentation parameters are chosen by human effort…

For certain infinitely-wide neural networks, the neural tangent kernel (NTK) theory fully characterizes generalization, but for the networks used in practice, the empirical NTK only provides a rough first-order approximation. Still, a…

Machine Learning · Computer Science 2021-10-14 Guillermo Ortiz-Jiménez , Seyed-Mohsen Moosavi-Dezfooli , Pascal Frossard

Localizing more sources than sensors with a sparse linear array (SLA) has long relied on minimizing a distance between two covariance matrices and recent algorithms often utilize semidefinite programming (SDP). Although deep neural network…

Signal Processing · Electrical Eng. & Systems 2025-03-11 Kuan-Lin Chen , Bhaskar D. Rao

Large language models (LLMs) have achieved remarkable success across widespread tasks, yet their application in low-resource domains remains a significant challenge due to data scarcity and the high risk of overfitting. While in-domain data…

Computation and Language · Computer Science 2025-11-11 Pingjie Wang , Hongcheng Liu , Yusheng Liao , Ziqing Fan , Yaxin Du , Shuo Tang , Yanfeng Wang , Yu Wang

We propose a novel method to explain trained deep neural networks (DNNs), by distilling them into surrogate models using unsupervised clustering. Our method can be applied flexibly to any subset of layers of a DNN architecture and can…

Computer Vision and Pattern Recognition · Computer Science 2020-07-17 Yu-han Liu , Sercan O. Arik
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