A calibration test for evaluating set-based epistemic uncertainty representations

Fuente: arXiv
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Autori principali: Jürgens, Mira, Mortier, Thomas, Hüllermeier, Eyke, Bengs, Viktor, Waegeman, Willem
Natura: Preprint
Pubblicazione: 2025
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author Jürgens, Mira
Mortier, Thomas
Hüllermeier, Eyke
Bengs, Viktor
Waegeman, Willem
author_facet Jürgens, Mira
Mortier, Thomas
Hüllermeier, Eyke
Bengs, Viktor
Waegeman, Willem
contents The accurate representation of epistemic uncertainty is a challenging yet essential task in machine learning. A widely used representation corresponds to convex sets of probabilistic predictors, also known as credal sets. One popular way of constructing these credal sets is via ensembling or specialized supervised learning methods, where the epistemic uncertainty can be quantified through measures such as the set size or the disagreement among members. In principle, these sets should contain the true data-generating distribution. As a necessary condition for this validity, we adopt the strongest notion of calibration as a proxy. Concretely, we propose a novel statistical test to determine whether there is a convex combination of the set's predictions that is calibrated in distribution. In contrast to previous methods, our framework allows the convex combination to be instance dependent, recognizing that different ensemble members may be better calibrated in different regions of the input space. Moreover, we learn this combination via proper scoring rules, which inherently optimize for calibration. Building on differentiable, kernel-based estimators of calibration errors, we introduce a nonparametric testing procedure and demonstrate the benefits of capturing instance-level variability on of synthetic and real-world experiments.
format Preprint
id arxiv_https___arxiv_org_abs_2502_16299
institution arXiv
publishDate 2025
record_format arxiv
spellingShingle A calibration test for evaluating set-based epistemic uncertainty representations
Jürgens, Mira
Mortier, Thomas
Hüllermeier, Eyke
Bengs, Viktor
Waegeman, Willem
Machine Learning
Artificial Intelligence
The accurate representation of epistemic uncertainty is a challenging yet essential task in machine learning. A widely used representation corresponds to convex sets of probabilistic predictors, also known as credal sets. One popular way of constructing these credal sets is via ensembling or specialized supervised learning methods, where the epistemic uncertainty can be quantified through measures such as the set size or the disagreement among members. In principle, these sets should contain the true data-generating distribution. As a necessary condition for this validity, we adopt the strongest notion of calibration as a proxy. Concretely, we propose a novel statistical test to determine whether there is a convex combination of the set's predictions that is calibrated in distribution. In contrast to previous methods, our framework allows the convex combination to be instance dependent, recognizing that different ensemble members may be better calibrated in different regions of the input space. Moreover, we learn this combination via proper scoring rules, which inherently optimize for calibration. Building on differentiable, kernel-based estimators of calibration errors, we introduce a nonparametric testing procedure and demonstrate the benefits of capturing instance-level variability on of synthetic and real-world experiments.
title A calibration test for evaluating set-based epistemic uncertainty representations
topic Machine Learning
Artificial Intelligence
url https://arxiv.org/abs/2502.16299