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This work introduces a novel probabilistic deep learning technique called deep Gaussian mixture ensembles (DGMEs), which enables accurate quantification of both epistemic and aleatoric uncertainty. By assuming the data generating process…

Machine Learning · Statistics 2023-06-13 Yousef El-Laham , Niccolò Dalmasso , Elizabeth Fons , Svitlana Vyetrenko

Despite its long history, Bayesian neural networks (BNNs) and variational training remain underused in practice: standard Gaussian posteriors misalign with network geometry, KL terms can be brittle in high dimensions, and implementations…

Machine Learning · Computer Science 2025-09-09 Carlos Stein Brito

Graph Convolutional Networks (GCNs) have emerged as powerful tools for learning on network structured data. Although empirically successful, GCNs exhibit certain behaviour that has no rigorous explanation -- for instance, the performance of…

Machine Learning · Computer Science 2023-11-07 Mahalakshmi Sabanayagam , Pascal Esser , Debarghya Ghoshdastidar

This work analyzes Graph Neural Networks, a generalization of Fully-Connected Deep Neural Nets on Graph structured data, when their width, that is the number of nodes in each fullyconnected layer is increasing to infinity. Infinite Width…

Machine Learning · Computer Science 2023-11-21 Yunus Cobanoglu

Contemporary deep neural networks exhibit impressive results on practical problems. These networks generalize well although their inherent capacity may extend significantly beyond the number of training examples. We analyze this behavior in…

Machine Learning · Computer Science 2015-09-03 Tamir Hazan , Tommi Jaakkola

While neural networks have demonstrated impressive performance across various tasks, accurately quantifying uncertainty in their predictions is essential to ensure their trustworthiness and enable widespread adoption in critical systems.…

Machine Learning · Statistics 2025-11-11 Joseph Wilson , Chris van der Heide , Liam Hodgkinson , Fred Roosta

Graph neural networks (GNNs) achieve remarkable performance in graph machine learning tasks but can be hard to train on large-graph data, where their learning dynamics are not well understood. We investigate the training dynamics of…

Machine Learning · Computer Science 2023-06-02 Sanjukta Krishnagopal , Luana Ruiz

The ``Neural Tangent Kernel'' (NTK) (Jacot et al 2018), and its empirical variants have been proposed as a proxy to capture certain behaviors of real neural networks. In this work, we study NTKs through the lens of scaling laws, and…

Machine Learning · Computer Science 2022-06-22 Nikhil Vyas , Yamini Bansal , Preetum Nakkiran

Bayesian neural networks (BNNs) combine the expressive power of deep learning with the advantages of Bayesian formalism. In recent years, the analysis of wide, deep BNNs has provided theoretical insight into their priors and posteriors.…

Machine Learning · Computer Science 2022-02-24 Beau Coker , Wessel P. Bruinsma , David R. Burt , Weiwei Pan , Finale Doshi-Velez

While deep neural networks (DNNs) and Gaussian Processes (GPs) are both popularly utilized to solve problems in reinforcement learning, both approaches feature undesirable drawbacks for challenging problems. DNNs learn complex nonlinear…

Machine Learning · Computer Science 2020-04-14 Imène R. Goumiri , Benjamin W. Priest , Michael D. Schneider

Operator learning techniques have recently emerged as a powerful tool for learning maps between infinite-dimensional Banach spaces. Trained under appropriate constraints, they can also be effective in learning the solution operator of…

Machine Learning · Computer Science 2021-10-13 Sifan Wang , Hanwen Wang , Paris Perdikaris

This paper aims to discuss the impact of random initialization of neural networks in the neural tangent kernel (NTK) theory, which is ignored by most recent works in the NTK theory. It is well known that as the network's width tends to…

Machine Learning · Statistics 2024-10-10 Guhan Chen , Yicheng Li , Qian Lin

Recent work has argued that neural networks can be understood theoretically by taking the number of channels to infinity, at which point the outputs become Gaussian process (GP) distributed. However, we note that infinite Bayesian neural…

Machine Learning · Statistics 2020-06-25 Laurence Aitchison

Neural bandits have been shown to provide an efficient solution to practical sequential decision tasks that have nonlinear reward functions. The main contributor to that success is approximate Bayesian inference, which enables neural…

Machine Learning · Computer Science 2022-10-11 Michal Lisicki , Arash Afkanpour , Graham W. Taylor

Deep Gaussian process models typically employ discrete hierarchies, but recent advancements in differential Gaussian processes (DiffGPs) have extended these models to infinite depths. However, existing DiffGP approaches often overlook the…

Machine Learning · Computer Science 2025-12-16 Jian Xu , Zhiqi Lin , Min Chen , Junmei Yang , Delu Zeng , John Paisley

Recent works have examined theoretical and empirical properties of wide neural networks trained in the Neural Tangent Kernel (NTK) regime. Given that biological neural networks are much wider than their artificial counterparts, we consider…

Machine Learning · Computer Science 2022-07-14 Akhilan Boopathy , Ila Fiete

Deep ensembles have recently gained popularity in the deep learning community for their conceptual simplicity and efficiency. However, maintaining functional diversity between ensemble members that are independently trained with gradient…

Machine Learning · Computer Science 2023-03-29 Francesco D'Angelo , Vincent Fortuin

Deep Gaussian processes (DGPs) are multi-layer hierarchical generalisations of Gaussian processes (GPs) and are formally equivalent to neural networks with multiple, infinitely wide hidden layers. DGPs are nonparametric probabilistic models…

In wide neural networks, the Neural Tangent Kernel (NTK) remains approximately constant during training, providing a powerful theoretical tool for studying training dynamics, generalization, and connections to kernel methods. However, this…

Machine Learning · Computer Science 2026-05-26 Jonathan Plenk , Sergio Calvo-Ordonez , Alvaro Cartea , Yarin Gal , Mark van der Wilk , Kamil Ciosek

One major impediment to the wider use of deep learning for clinical decision making is the difficulty of assigning a level of confidence to model predictions. Currently, deep Bayesian neural networks and sparse Gaussian processes are the…