Nonparametric Distribution Regression Re-calibration
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Abstract (arXiv)
A key challenge in probabilistic regression is ensuring that predictive distributions accurately reflect true empirical uncertainty. Minimizing overall prediction error often encourages models to prioritize informativeness over calibration, producing narrow but overconfident predictions. However, in safety-critical settings, trustworthy uncertainty estimates are often more valuable than narrow intervals. Realizing the problem, several recent works have focused on post-hoc corrections; however, existing methods either rely on weak notions of calibration (such as PIT uniformity) or impose restrictive parametric assumptions on the nature of the error. To address these limitations, we propose a novel nonparametric re-calibration algorithm based on conditional kernel mean embeddings, capable of correcting calibration error without restrictive modeling assumptions. For efficient inference with real-valued targets, we introduce a novel characteristic kernel over distributions that can be evaluated in O(n log n) time for empirical distributions of size n. We demonstrate that our method consistently outperforms prior re-calibration approaches across a diverse set of regression benchmarks and model classes.
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References · 21
- 2017On Calibration of Modern Neural Networkscited by 4,860
- 2015Dropout as a Bayesian Approximation: Representing Model Uncertainty in Deep Learningcited by 4,416
- 2018Accurate Uncertainties for Deep Learning Using Calibrated Regressioncited by 417
- 2021Revisiting the Calibration of Modern Neural Networkscited by 387
- 2016Kernel Mean Embedding of Distributions: A Review and Beyondcited by 360
- 2019Beyond temperature scaling: Obtaining well-calibrated multiclass probabilities with Dirichlet calibrationcited by 359
- 2015Probabilistic Backpropagation for Scalable Learning of Bayesian Neural Networkscited by 295
- 2020Conformal Prediction: a Unified Review of Theory and New Challengescited by 118
- 2019Distribution Calibration for Regressioncited by 88
- 2020A Measure-Theoretic Approach to Kernel Conditional Mean Embeddingscited by 86
- 2022Better Uncertainty Calibration via Proper Scores for Classification and Beyondcited by 65
- 2020Distributional Random Forests: Heterogeneity Adjustment and Multivariate Distributional Regressioncited by 36
9 more
- 2022Beyond calibration: estimating the grouping loss of modern neural networkscited by 32
- 2021Regression Diagnostics meets Forecast Evaluation: Conditional Calibration, Reliability Diagrams, and Coefficient of Determinationcited by 31
- 2021Local Calibration: Metrics and Recalibrationcited by 23
- 2022Calibration tests beyond classificationcited by 20
- 2023Calibration by Distribution Matching: Trainable Kernel Calibration Metricscited by 20
- 2019Kernel Conditional Density Operatorscited by 14
- 2015Cross-calibration of probabilistic forecastscited by 2
- 2025All Models Are Miscalibrated, But Some Less So: Comparing Calibration with Conditional Mean Operatorscited by 2
- 2025Fast and Scalable Score-Based Kernel Calibration Testscited by 2
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