On the bias of K-fold cross validation with stable learners
Anass Aghbalou, Anne Sabourin, François Portier
Abstract
This paper investigates the efficiency of the K-fold cross-validation (CV) procedure and a debiased version thereof as a means of estimating the generalization risk of a learning algorithm. We work under the general assumption of uniform algorithmic stability. We show that the K-fold risk estimate may not be consistent under such general stability assumptions, by constructing non vanishing lower bounds on the error in realistic contexts such as regularized empirical risk minimisation and stochastic gradient descent. We thus advocate the use of a debiased version of the K-fold and prove an error bound with exponential tail decay regarding this version. Our result is applicable to the large class of uniformly stable algorithms, contrarily to earlier works focusing on specific tasks such as density estimation. We illustrate the relevance of the debiased K-fold CV on a simple model selection problem and demonstrate empirically the usefulness of the promoted approach on real world classification and regression datasets.
BibTeX
@InProceedings{pmlr-v206-aghbalou23a,
title = {On the bias of K-fold cross validation with stable learners},
author = {Aghbalou, Anass and Sabourin, Anne and Portier, Fran\c{c}ois},
booktitle = {Proceedings of The 26th International Conference on Artificial Intelligence and Statistics},
pages = {3775--3794},
year = {2023},
editor = {Ruiz, Francisco and Dy, Jennifer and van de Meent, Jan-Willem},
volume = {206},
series = {Proceedings of Machine Learning Research},
month = {25--27 Apr},
publisher = {PMLR},
pdf = {https://proceedings.mlr.press/v206/aghbalou23a/aghbalou23a.pdf},
url = {https://proceedings.mlr.press/v206/aghbalou23a.html},
abstract = {This paper investigates the efficiency of the K-fold cross-validation (CV) procedure and a debiased version thereof as a means of estimating the generalization risk of a learning algorithm. We work under the general assumption of uniform algorithmic stability. We show that the K-fold risk estimate may not be consistent under such general stability assumptions, by constructing non vanishing lower bounds on the error in realistic contexts such as regularized empirical risk minimisation and stochastic gradient descent. We thus advocate the use of a debiased version of the K-fold and prove an error bound with exponential tail decay regarding this version. Our result is applicable to the large class of uniformly stable algorithms, contrarily to earlier works focusing on specific tasks such as density estimation. We illustrate the relevance of the debiased K-fold CV on a simple model selection problem and demonstrate empirically the usefulness of the promoted approach on real world classification and regression datasets.}
}