Diffusion Models for Constrained Domains

Fuente: arXiv
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Main Authors: Fishman, Nic, Klarner, Leo, De Bortoli, Valentin, Mathieu, Emile, Hutchinson, Michael
Format: Preprint
Published: 2023
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author Fishman, Nic
Klarner, Leo
De Bortoli, Valentin
Mathieu, Emile
Hutchinson, Michael
author_facet Fishman, Nic
Klarner, Leo
De Bortoli, Valentin
Mathieu, Emile
Hutchinson, Michael
contents Denoising diffusion models are a novel class of generative algorithms that achieve state-of-the-art performance across a range of domains, including image generation and text-to-image tasks. Building on this success, diffusion models have recently been extended to the Riemannian manifold setting, broadening their applicability to a range of problems from the natural and engineering sciences. However, these Riemannian diffusion models are built on the assumption that their forward and backward processes are well-defined for all times, preventing them from being applied to an important set of tasks that consider manifolds defined via a set of inequality constraints. In this work, we introduce a principled framework to bridge this gap. We present two distinct noising processes based on (i) the logarithmic barrier metric and (ii) the reflected Brownian motion induced by the constraints. As existing diffusion model techniques cannot be applied in this setting, we derive new tools to define such models in our framework. We then demonstrate the practical utility of our methods on a number of synthetic and real-world tasks, including applications from robotics and protein design.
format Preprint
id arxiv_https___arxiv_org_abs_2304_05364
institution arXiv
publishDate 2023
record_format arxiv
spellingShingle Diffusion Models for Constrained Domains
Fishman, Nic
Klarner, Leo
De Bortoli, Valentin
Mathieu, Emile
Hutchinson, Michael
Machine Learning
Denoising diffusion models are a novel class of generative algorithms that achieve state-of-the-art performance across a range of domains, including image generation and text-to-image tasks. Building on this success, diffusion models have recently been extended to the Riemannian manifold setting, broadening their applicability to a range of problems from the natural and engineering sciences. However, these Riemannian diffusion models are built on the assumption that their forward and backward processes are well-defined for all times, preventing them from being applied to an important set of tasks that consider manifolds defined via a set of inequality constraints. In this work, we introduce a principled framework to bridge this gap. We present two distinct noising processes based on (i) the logarithmic barrier metric and (ii) the reflected Brownian motion induced by the constraints. As existing diffusion model techniques cannot be applied in this setting, we derive new tools to define such models in our framework. We then demonstrate the practical utility of our methods on a number of synthetic and real-world tasks, including applications from robotics and protein design.
title Diffusion Models for Constrained Domains
topic Machine Learning
url https://arxiv.org/abs/2304.05364