On Local Posterior Structure in Deep Ensembles

Fuente: arXiv
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Auteurs principaux: Jordahn, Mikkel, Jensen, Jonas Vestergaard, Schmidt, Mikkel N., Andersen, Michael Riis
Format: Preprint
Publié: 2025
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author Jordahn, Mikkel
Jensen, Jonas Vestergaard
Schmidt, Mikkel N.
Andersen, Michael Riis
author_facet Jordahn, Mikkel
Jensen, Jonas Vestergaard
Schmidt, Mikkel N.
Andersen, Michael Riis
contents Bayesian Neural Networks (BNNs) often improve model calibration and predictive uncertainty quantification compared to point estimators such as maximum-a-posteriori (MAP). Similarly, deep ensembles (DEs) are also known to improve calibration, and therefore, it is natural to hypothesize that deep ensembles of BNNs (DE-BNNs) should provide even further improvements. In this work, we systematically investigate this across a number of datasets, neural network architectures, and BNN approximation methods and surprisingly find that when the ensembles grow large enough, DEs consistently outperform DE-BNNs on in-distribution data. To shine light on this observation, we conduct several sensitivity and ablation studies. Moreover, we show that even though DE-BNNs outperform DEs on out-of-distribution metrics, this comes at the cost of decreased in-distribution performance. As a final contribution, we open-source the large pool of trained models to facilitate further research on this topic.
format Preprint
id arxiv_https___arxiv_org_abs_2503_13296
institution arXiv
publishDate 2025
record_format arxiv
spellingShingle On Local Posterior Structure in Deep Ensembles
Jordahn, Mikkel
Jensen, Jonas Vestergaard
Schmidt, Mikkel N.
Andersen, Michael Riis
Machine Learning
Bayesian Neural Networks (BNNs) often improve model calibration and predictive uncertainty quantification compared to point estimators such as maximum-a-posteriori (MAP). Similarly, deep ensembles (DEs) are also known to improve calibration, and therefore, it is natural to hypothesize that deep ensembles of BNNs (DE-BNNs) should provide even further improvements. In this work, we systematically investigate this across a number of datasets, neural network architectures, and BNN approximation methods and surprisingly find that when the ensembles grow large enough, DEs consistently outperform DE-BNNs on in-distribution data. To shine light on this observation, we conduct several sensitivity and ablation studies. Moreover, we show that even though DE-BNNs outperform DEs on out-of-distribution metrics, this comes at the cost of decreased in-distribution performance. As a final contribution, we open-source the large pool of trained models to facilitate further research on this topic.
title On Local Posterior Structure in Deep Ensembles
topic Machine Learning
url https://arxiv.org/abs/2503.13296