(De)-regularized Maximum Mean Discrepancy Gradient FlowZonghao Chen, Aratrika Mustafi, Pierre Glaser et al.
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.
4.5MLOct 15, 2025
Near-Optimality of Contrastive Divergence AlgorithmsPierre Glaser, Kevin Han Huang, Arthur Gretton
We perform a non-asymptotic analysis of the contrastive divergence (CD) algorithm, a training method for unnormalized models. While prior work has established that (for exponential family distributions) the CD iterates asymptotically converge at an $O(n^{-1 / 3})$ rate to the true parameter of the data distribution, we show, under some regularity assumptions, that CD can achieve the parametric rate $O(n^{-1 / 2})$. Our analysis provides results for various data batching schemes, including the fully online and minibatch ones. We additionally show that CD can be near-optimal, in the sense that its asymptotic variance is close to the Cramér-Rao lower bound.
KALE Flow: A Relaxed KL Gradient Flow for Probabilities with Disjoint SupportPierre Glaser, Michael Arbel, Arthur Gretton
We study the gradient flow for a relaxed approximation to the Kullback-Leibler (KL) divergence between a moving source and a fixed target distribution. This approximation, termed the KALE (KL approximate lower-bound estimator), solves a regularized version of the Fenchel dual problem defining the KL over a restricted class of functions. When using a Reproducing Kernel Hilbert Space (RKHS) to define the function class, we show that the KALE continuously interpolates between the KL and the Maximum Mean Discrepancy (MMD). Like the MMD and other Integral Probability Metrics, the KALE remains well defined for mutually singular distributions. Nonetheless, the KALE inherits from the limiting KL a greater sensitivity to mismatch in the support of the distributions, compared with the MMD. These two properties make the KALE gradient flow particularly well suited when the target distribution is supported on a low-dimensional manifold. Under an assumption of sufficient smoothness of the trajectories, we show the global convergence of the KALE flow. We propose a particle implementation of the flow given initial samples from the source and the target distribution, which we use to empirically confirm the KALE's properties.