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Model selection is a strategy aimed at creating accurate and robust models. A key challenge in designing these algorithms is identifying the optimal model for classifying any particular input sample. This paper addresses this challenge and…

Machine Learning · Computer Science 2023-05-22 James Kotary , Vincenzo Di Vito , Ferdinando Fioretto

Ensemble learning improves classification performance by combining multiple base classifiers. While increasing the number of classifiers generally enhances accuracy, excessively large ensembles can lead to computational inefficiency and…

Machine Learning · Computer Science 2025-11-27 Enes Bektas , Fazli Can

Ensembling deep learning models is a shortcut to promote its implementation in new scenarios, which can avoid tuning neural networks, losses and training algorithms from scratch. However, it is difficult to collect sufficient accurate and…

Machine Learning · Computer Science 2020-12-04 Jun Yang , Fei Wang

Recently, the benefit of heavily overparameterized models has been observed in machine learning tasks: models with enough capacity to easily cross the \emph{interpolation threshold} improve in generalization error compared to the classical…

High Energy Physics - Experiment · Physics 2025-09-03 Matthias Vigl , Lukas Heinrich

We establish the first mathematically rigorous link between Bayesian, variational Bayesian, and ensemble methods. A key step towards this it to reformulate the non-convex optimisation problem typically encountered in deep learning as a…

Machine Learning · Statistics 2023-10-24 Veit David Wild , Sahra Ghalebikesabi , Dino Sejdinovic , Jeremias Knoblauch

The contribution of this work is twofold: (1) We introduce a collection of ensemble methods for time series forecasting to combine predictions from base models. We demonstrate insights on the power of ensemble learning for forecasting,…

Machine Learning · Computer Science 2021-04-26 Julia Gastinger , Sébastien Nicolas , Dušica Stepić , Mischa Schmidt , Anett Schülke

While deep ensembles are widely considered to be the default method for uncertainty quantification in deep learning, their effectiveness for graph-structured data is often simply assumed based on successes in domains like computer vision.…

Machine Learning · Computer Science 2026-05-22 Pedro C. Vieira , Pedro Ribeiro , Viacheslav Borovitskiy

Both the median-based classifier and the quantile-based classifier are useful for discriminating high-dimensional data with heavy-tailed or skewed inputs. But these methods are restricted as they assign equal weight to each variable in an…

Machine Learning · Statistics 2019-10-30 Yuanhao Lai , Ian McLeod

The sampling problem lies at the heart of atomistic simulations and over the years many different enhanced sampling methods have been suggested towards its solution. These methods are often grouped into two broad families. On the one hand…

Computational Physics · Physics 2020-11-25 Michele Invernizzi , Pablo Miguel Piaggi , Michele Parrinello

Traffic flow forecasting is a crucial task in intelligent transport systems. Deep learning offers an effective solution, capturing complex patterns in time-series traffic flow data to enable the accurate prediction. However, deep learning…

Machine Learning · Computer Science 2024-11-07 Qiyuan Zhu , A. K. Qin , Hussein Dia , Adriana-Simona Mihaita , Hanna Grzybowska

Decomposing prediction uncertainty into aleatoric (irreducible) and epistemic (reducible) components is critical for the reliable deployment of machine learning systems. While the mutual information between the response variable and model…

Machine Learning · Statistics 2026-02-10 Anchit Jain , Stephen Bates

Despite the rich literature on machine learning fairness, relatively little attention has been paid to remediating complex systems, where the final prediction is the combination of multiple classifiers and where multiple groups are present.…

Machine Learning · Computer Science 2023-07-13 James Atwood , Tina Tian , Ben Packer , Meghana Deodhar , Jilin Chen , Alex Beutel , Flavien Prost , Ahmad Beirami

Feature-importance methods show promise in transforming machine learning models from predictive engines into tools for scientific discovery. However, due to data sampling and algorithmic stochasticity, expressive models can be unstable,…

Machine Learning · Statistics 2026-05-29 Joseph Paillard , Angel Reyero Lobo , Denis A. Engemann , Bertrand Thirion

A memory efficient approach to ensembling neural networks is to share most weights among the ensembled models by means of a single reference network. We refer to this strategy as Embedded Ensembling (EE); its particular examples are…

Machine Learning · Statistics 2022-02-25 Maksim Velikanov , Roman Kail , Ivan Anokhin , Roman Vashurin , Maxim Panov , Alexey Zaytsev , Dmitry Yarotsky

Advances in data collecting technologies in genomics have significantly increased the need for tools designed to study the genetic basis of many diseases. Effective statistical methods should excel in both prediction accuracy and biomarker…

Methodology · Statistics 2025-11-13 Anthony-Alexander Christidis , Stefan Van Aelst , Ruben Zamar

State-of-the-art models often make use of superficial patterns in the data that do not generalize well to out-of-domain or adversarial settings. For example, textual entailment models often learn that particular key words imply entailment,…

Computation and Language · Computer Science 2019-09-10 Christopher Clark , Mark Yatskar , Luke Zettlemoyer

Ensemble of models is well known to improve single model performance. We present a novel ensembling technique coined MAC that is designed to find the optimal function for combining models while remaining invariant to the number of…

Machine Learning · Computer Science 2020-06-17 Ohad Silbert , Yitzhak Peleg , Evi Kopelowitz

Safety filters in control systems correct nominal controls that violate safety constraints. Designing such filters as functions of visual observations in uncertain and complex environments is challenging. Several deep learning-based…

Machine Learning · Computer Science 2024-12-04 Ihab Tabbara , Hussein Sibai

With the recent growth in data availability and complexity, and the associated outburst of elaborate modelling approaches, model selection tools have become a lifeline, providing objective criteria to deal with this increasingly challenging…

Methodology · Statistics 2020-10-08 Alessandro Casa , Luca Scrucca , Giovanna Menardi

Cross-study replicability is a powerful model evaluation criterion that emphasizes generalizability of predictions. When training cross-study replicable prediction models, it is critical to decide between merging and treating the studies…

Machine Learning · Statistics 2022-07-14 Cathy Shyr , Pragya Sur , Giovanni Parmigiani , Prasad Patil