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Gaussian process ($GP$) regression is a widely used non-parametric modeling tool, but its cubic complexity in the training size limits its use on massive data sets. A practical remedy is to predict using only the nearest neighbours of each…

Machine Learning · Statistics 2026-04-09 Robert Allison , Tomasz Maciazek , Anthony Stephenson

We present a stepwise approach to estimate high dimensional Gaussian graphical models. We exploit the relation between the partial correlation coefficients and the distribution of the prediction errors, and parametrize the model in terms of…

Methodology · Statistics 2018-08-21 Ginette Lafit , Francisco J. Nogales , Marcelo Ruiz , Ruben H. Zamar

The expressive power of Bayesian kernel-based methods has led them to become an important tool across many different facets of artificial intelligence, and useful to a plethora of modern application domains, providing both power and…

Machine Learning · Computer Science 2021-07-13 Luca Martino , Jesse Read

Overtaking in high-speed autonomous racing demands precise, real-time estimation of collision risk; particularly in wheel-to-wheel scenarios where safety margins are minimal. Existing methods for collision risk estimation either rely on…

Robotics · Computer Science 2025-10-02 Trent Weiss , Madhur Behl

Gaussian graphical regression is a powerful means that regresses the precision matrix of a Gaussian graphical model on covariates, permitting the numbers of the response variables and covariates to far exceed the sample size. Model fitting…

Methodology · Statistics 2022-05-24 Jingfei Zhang , Yi Li

Based on the method by [K\"uc95], we give a procedure to list up all complete intersection Calabi--Yau manifolds with respect to direct sums of irreducible homogeneous vector bundles on Grassmannians for each dimension. In particular, we…

Algebraic Geometry · Mathematics 2019-01-18 Daisuke Inoue , Atsushi Ito , Makoto Miura

Multi-output Gaussian process (MGP) models have attracted significant attention for their flexibility and uncertainty-quantification capabilities, and have been widely adopted in multi-source transfer learning scenarios due to their ability…

Machine Learning · Computer Science 2025-12-12 Duo Wang , Xinming Wang , Chao Wang , Xiaowei Yue , Jianguo Wu

Studies of Higgs boson properties are crucial for the understanding the Standard Model (SM), as it could couple to new particles and provide hints to physics Beyond the Standard Model (BSM). Different future colliders are proposed, among…

High Energy Physics - Experiment · Physics 2026-04-03 Kevin Dewyspelaere , Giacomo Da Molin , Giovanni Battista Marozzo , Michele Gallinaro

Gaussian processes (GP) are a widely used model for regression problems in supervised machine learning. Implementation of GP regression typically requires $O(n^3)$ logic gates. We show that the quantum linear systems algorithm [Harrow et…

Quantum Physics · Physics 2019-05-29 Zhikuan Zhao , Jack K. Fitzsimons , Joseph F. Fitzsimons

Federated learning faces significant challenges in scenarios with heterogeneous data distributions and adverse network conditions, such as delays, packet loss, and data poisoning attacks. This paper proposes a novel method based on the…

Machine Learning · Computer Science 2025-01-28 Mohammad Ghabel Rahmat , Majid Khalilian

This chapter discusses the importance of incorporating three-dimensional symmetries in the context of statistical learning models geared towards the interpolation of the tensorial properties of atomic-scale structures. We focus on Gaussian…

Chemical Physics · Physics 2019-04-04 Andrea Grisafi , David M. Wilkins , Michael J. Willatt , Michele Ceriotti

We apply machine learning to the problem of finding numerical Calabi-Yau metrics. We extend previous work on learning approximate Ricci-flat metrics calculated using Donaldson's algorithm to the much more accurate "optimal" metrics of…

High Energy Physics - Theory · Physics 2022-09-07 Anthony Ashmore , Lucille Calmon , Yang-Hui He , Burt A. Ovrut

This paper is an attempt to bridge the conceptual gaps between researchers working on the two widely used approaches based on positive definite kernels: Bayesian learning or inference using Gaussian processes on the one side, and…

Machine Learning · Statistics 2018-07-10 Motonobu Kanagawa , Philipp Hennig , Dino Sejdinovic , Bharath K Sriperumbudur

Multigrid methods have proven to be an invaluable tool to efficiently solve large sparse linear systems arising in the discretization of partial differential equations (PDEs). Algebraic multigrid methods and in particular adaptive algebraic…

Numerical Analysis · Mathematics 2020-04-27 Hanno Gottschalk , Karsten Kahl

A dataset of fully quantum flux-flux correlation functions and reaction rate constants was constructed for organic heterogeneous catalytic surface reactions. Gaussian process regressors were successfully fitted to training data to predict…

Chemical Physics · Physics 2022-06-07 Brenden G. Pelkie , Stephanie Valleau

Although Gaussian processes (GPs) with deep kernels have been successfully used for meta-learning in regression tasks, its uncertainty estimation performance can be poor. We propose a meta-learning method for calibrating deep kernel GPs for…

Machine Learning · Statistics 2023-12-14 Tomoharu Iwata , Atsutoshi Kumagai

The kernel function and its hyperparameters are the central model selection choice in a Gaussian proces (Rasmussen and Williams, 2006). Typically, the hyperparameters of the kernel are chosen by maximising the marginal likelihood, an…

Machine Learning · Statistics 2022-11-07 Vidhi Lalchand , Wessel P. Bruinsma , David R. Burt , Carl E. Rasmussen

We consider the problem of estimating the parameters of the covariance function of a Gaussian process by cross-validation. We suggest using new cross-validation criteria derived from the literature of scoring rules. We also provide an…

Computation · Statistics 2020-08-07 Sébastien Petit , Julien Bect , Sébastien da Veiga , Paul Feliot , Emmanuel Vazquez

Gaussian process regression machine learning with a physically-informed kernel is used to model the phase compositions of nickel-base superalloys. The model delivers good predictions for laboratory and commercial superalloys, with $R^2>0.8$…

Materials Science · Physics 2021-09-29 Patrick L. Taylor , Gareth Conduit

Gaussian Processes (GPs) are a generic modelling tool for supervised learning. While they have been successfully applied on large datasets, their use in safety-critical applications is hindered by the lack of good performance guarantees. To…

Machine Learning · Statistics 2019-08-27 David Reeb , Andreas Doerr , Sebastian Gerwinn , Barbara Rakitsch