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Diagnosing and Fixing Manifold Overfitting in Deep Generative Models

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arxiv 2204.07172 v4 pith:6GKZG5CS submitted 2022-04-14 stat.ML cs.AIcs.LGstat.ME

classification stat.MLcs.AIcs.LGstat.ME
keywords manifoldmodelsgenerativeoverfittingproceduresclassdeepdensity
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Likelihood-based, or explicit, deep generative models use neural networks to construct flexible high-dimensional densities. This formulation directly contradicts the manifold hypothesis, which states that observed data lies on a low-dimensional manifold embedded in high-dimensional ambient space. In this paper we investigate the pathologies of maximum-likelihood training in the presence of this dimensionality mismatch. We formally prove that degenerate optima are achieved wherein the manifold itself is learned but not the distribution on it, a phenomenon we call manifold overfitting. We propose a class of two-step procedures consisting of a dimensionality reduction step followed by maximum-likelihood density estimation, and prove that they recover the data-generating distribution in the nonparametric regime, thus avoiding manifold overfitting. We also show that these procedures enable density estimation on the manifolds learned by implicit models, such as generative adversarial networks, hence addressing a major shortcoming of these models. Several recently proposed methods are instances of our two-step procedures; we thus unify, extend, and theoretically justify a large class of models.

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    A normalizing flow with a mixture-of-Gaussians latent space and a quadratic post-hoc approximation yields higher-order correlations and curvature estimates for neural manifolds in macaque visual cortex.

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