(De)-regularized Maximum Mean Discrepancy Gradient Flow

Fuente: arXiv
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Main Authors: Chen, Zonghao, Mustafi, Aratrika, Glaser, Pierre, Korba, Anna, Gretton, Arthur, Sriperumbudur, Bharath K.
Format: Preprint
Published: 2024
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author Chen, Zonghao
Mustafi, Aratrika
Glaser, Pierre
Korba, Anna
Gretton, Arthur
Sriperumbudur, Bharath K.
author_facet Chen, Zonghao
Mustafi, Aratrika
Glaser, Pierre
Korba, Anna
Gretton, Arthur
Sriperumbudur, Bharath K.
contents We introduce a (de)-regularization of the Maximum Mean Discrepancy (DrMMD) and its Wasserstein gradient flow. Existing gradient flows that transport samples from source distribution to target distribution with only target samples, either lack tractable numerical implementation ($f$-divergence flows) or require strong assumptions, and modifications such as noise injection, to ensure convergence (Maximum Mean Discrepancy flows). In contrast, DrMMD flow can simultaneously (i) guarantee near-global convergence for a broad class of targets in both continuous and discrete time, and (ii) be implemented in closed form using only samples. The former is achieved by leveraging the connection between the DrMMD and the $χ^2$-divergence, while the latter comes by treating DrMMD as MMD with a de-regularized kernel. Our numerical scheme uses an adaptive de-regularization schedule throughout the flow to optimally trade off between discretization errors and deviations from the $χ^2$ regime. The potential application of the DrMMD flow is demonstrated across several numerical experiments, including a large-scale setting of training student/teacher networks.
format Preprint
id arxiv_https___arxiv_org_abs_2409_14980
institution arXiv
publishDate 2024
record_format arxiv
spellingShingle (De)-regularized Maximum Mean Discrepancy Gradient Flow
Chen, Zonghao
Mustafi, Aratrika
Glaser, Pierre
Korba, Anna
Gretton, Arthur
Sriperumbudur, Bharath K.
Machine Learning
We introduce a (de)-regularization of the Maximum Mean Discrepancy (DrMMD) and its Wasserstein gradient flow. Existing gradient flows that transport samples from source distribution to target distribution with only target samples, either lack tractable numerical implementation ($f$-divergence flows) or require strong assumptions, and modifications such as noise injection, to ensure convergence (Maximum Mean Discrepancy flows). In contrast, DrMMD flow can simultaneously (i) guarantee near-global convergence for a broad class of targets in both continuous and discrete time, and (ii) be implemented in closed form using only samples. The former is achieved by leveraging the connection between the DrMMD and the $χ^2$-divergence, while the latter comes by treating DrMMD as MMD with a de-regularized kernel. Our numerical scheme uses an adaptive de-regularization schedule throughout the flow to optimally trade off between discretization errors and deviations from the $χ^2$ regime. The potential application of the DrMMD flow is demonstrated across several numerical experiments, including a large-scale setting of training student/teacher networks.
title (De)-regularized Maximum Mean Discrepancy Gradient Flow
topic Machine Learning
url https://arxiv.org/abs/2409.14980