English
Related papers

Related papers: Optimizing Approximate Leave-one-out Cross-validat…

200 papers

Regularization is a popular technique in machine learning for model estimation and avoiding overfitting. Prior studies have found that modern ordered regularization can be more effective in handling highly correlated, high-dimensional data…

Machine Learning · Computer Science 2019-11-01 Mahammad Humayoo , Xueqi Cheng

Logistic regression is a ubiquitous method for probabilistic classification. However, the effectiveness of logistic regression depends upon careful and relatively computationally expensive tuning, especially for the regularisation…

Machine Learning · Computer Science 2025-04-04 Angus Dempster , Geoffrey I. Webb , Daniel F. Schmidt

We show how to adjust the coefficient of determination ($R^2$) when used for measuring predictive accuracy via leave-one-out cross-validation.

Machine Learning · Computer Science 2016-05-06 Indre Zliobaite , Nikolaj Tatti

Cross-validation (CV) is a technique for evaluating the ability of statistical models/learning systems based on a given data set. Despite its wide applicability, the rather heavy computational cost can prevent its use as the system size…

Machine Learning · Statistics 2016-10-26 Yoshiyuki Kabashima , Tomoyuki Obuchi , Makoto Uemura

Estimating out-of-sample risk for models trained on large high-dimensional datasets is an expensive but essential part of the machine learning process, enabling practitioners to optimally tune hyperparameters. Cross-validation (CV) serves…

Statistics Theory · Mathematics 2025-04-28 Parth Nobel , Daniel LeJeune , Emmanuel J. Candès

In order to improve reproducibility, deep reinforcement learning (RL) has been adopting better scientific practices such as standardized evaluation metrics and reporting. However, the process of hyperparameter optimization still varies…

Machine Learning · Computer Science 2023-06-05 Theresa Eimer , Marius Lindauer , Roberta Raileanu

Most models in machine learning contain at least one hyperparameter to control for model complexity. Choosing an appropriate set of hyperparameters is both crucial in terms of model accuracy and computationally challenging. In this work we…

Machine Learning · Statistics 2022-11-22 Fabian Pedregosa

In spite of the wealth of literature on the theoretical properties of the Lasso, there is very little known when the value of the tuning parameter is chosen using the data, even though this is what actually happens in practice. We give a…

Statistics Theory · Mathematics 2016-09-02 Sourav Chatterjee , Jafar Jafarov

High-dimensional predictive models, those with more measurements than observations, require regularization to be well defined, perform well empirically, and possess theoretical guarantees. The amount of regularization, often determined by…

Methodology · Statistics 2019-07-16 Darren Homrighausen , Daniel J. McDonald

This study examines generalized cross-validation for the tuning parameter selection for ridge regression in high-dimensional misspecified linear models. The set of candidates for the tuning parameter includes not only positive values but…

Statistics Theory · Mathematics 2026-01-21 Akira Shinkyu

Model regularization requires extensive manual tuning to balance complexity against overfitting. Cross-regularization resolves this tradeoff by directly adapting regularization parameters through validation gradients during training. The…

Machine Learning · Computer Science 2025-06-25 Carlos Stein Brito

Leave-one-problem-out (LOPO) performance prediction requires machine learning (ML) models to extrapolate algorithms' performance from a set of training problems to a previously unseen problem. LOPO is a very challenging task even for…

Machine Learning · Computer Science 2023-06-01 Ana Nikolikj , Michal Pluháček , Carola Doerr , Peter Korošec , Tome Eftimov

We describe a fast computation method for leave-one-out cross-validation (LOOCV) for $k$-nearest neighbours ($k$-NN) regression. We show that, under a tie-breaking condition for nearest neighbours, the LOOCV estimate of the mean square…

Machine Learning · Statistics 2024-12-05 Motonobu Kanagawa

When selecting a classification algorithm to be applied to a particular problem, one has to simultaneously select the best algorithm for that dataset \emph{and} the best set of hyperparameters for the chosen model. The usual approach is to…

Machine Learning · Computer Science 2018-09-26 Jacques Wainer , Gavin Cawley

Model overconfidence and poor calibration are common in machine learning and difficult to account for when applying standard empirical risk minimization. In this work, we propose a novel method to alleviate these problems that we call…

Machine Learning · Computer Science 2024-02-13 Lukas Muttenthaler , Robert A. Vandermeulen , Qiuyi Zhang , Thomas Unterthiner , Klaus-Robert Müller

Two OFFO (Objective-Function Free Optimization) noise tolerant algorithms are presented that handle bound constraints, inexact gradients and use second-order information when available.The first is a multi-level method exploiting a…

Optimization and Control · Mathematics 2025-07-16 Serge Gratton , Alena Kopaničáková , Philippe Toint

Data subject to heavy-tailed errors are commonly encountered in various scientific fields, especially in the modern era with explosion of massive data. To address this problem, procedures based on quantile regression and Least Absolute…

Statistics Theory · Mathematics 2014-10-09 Jianqing Fan , Quefeng Li , Yuyan Wang

Setting regularization parameters for Lasso-type estimators is notoriously difficult, though crucial in practice. The most popular hyperparameter optimization approach is grid-search using held-out validation data. Grid-search however…

Evaluating the predictive performance of a statistical model is commonly done using cross-validation. Among the various methods, leave-one-out cross-validation (LOOCV) is frequently used. Originally designed for exchangeable observations,…

Computation · Statistics 2025-07-04 Zhedong Liu , Janet Van Niekerk , Haavard Rue

Matrix-based optimizers have attracted growing interest for improving LLM training efficiency, with significant progress centered on orthogonalization/whitening based methods. While yielding substantial performance gains, a fundamental…

Machine Learning · Computer Science 2026-02-10 Wenbo Gong , Javier Zazo , Qijun Luo , Puqian Wang , James Hensman , Chao Ma