On the Effect of Regularization on Nonparametric Mean-Variance Regression
Eliot Wong-Toi, Alex Boyd, Vincent Fortuin, Stephan Mandt

TL;DR
This paper investigates how regularization influences the behavior of nonparametric mean-variance regression models, revealing a phase transition that affects uncertainty quantification and proposing a theoretical framework to understand this phenomenon.
Contribution
The paper introduces a statistical field theory framework that explains the phase transition caused by regularization in mean-variance regression models, simplifying hyperparameter tuning.
Findings
Identifies a sharp phase transition driven by regularization in mean-variance models.
Develops a theoretical model aligning with empirical observations of the transition.
Demonstrates improved uncertainty quantification on real datasets.
Abstract
Uncertainty quantification is vital for decision-making and risk assessment in machine learning. Mean-variance regression models, which predict both a mean and residual noise for each data point, provide a simple approach to uncertainty quantification. However, overparameterized mean-variance models struggle with signal-to-noise ambiguity, deciding whether prediction targets should be attributed to signal (mean) or noise (variance). At one extreme, models fit all training targets perfectly with zero residual noise, while at the other, they provide constant, uninformative predictions and explain the targets as noise. We observe a sharp phase transition between these extremes, driven by model regularization. Empirical studies with varying regularization levels illustrate this transition, revealing substantial variability across repeated runs. To explain this behavior, we develop a…
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Taxonomy
TopicsExplainable Artificial Intelligence (XAI) · Machine Learning in Materials Science · Machine Learning and Data Classification
