Scalable Wasserstein Gradient Flow for Generative Modeling through Unbalanced Optimal Transport

Wasserstein Gradient Flow (WGF) describes the gradient dynamics of probability density within the Wasserstein space. WGF provides a promising approach for conducting optimization over the probability distributions. Numerically approximating the continuous WGF requires the time discretization method. The most well-known method for this is the JKO scheme. In this regard, previous WGF models employ the JKO scheme and parametrize transport map for each JKO step. However, this approach results in quadratic training complexity $O(K^2)$ with the number of JKO step $K$. This severely limits the scalability of WGF models. In this paper, we introduce a scalable WGF-based generative model, called Semi-dual JKO (S-JKO). Our model is based on the semi-dual form of the JKO step, derived from the equivalence between the JKO step and the Unbalanced Optimal Transport. Our approach reduces the training complexity to $O(K)$. We demonstrate that our model significantly outperforms existing WGF-based generative models, achieving FID scores of 2.62 on CIFAR-10 and 6.19 on CelebA-HQ-256, which are comparable to state-of-the-art image generative models.

Analyzing and Improving OT-based Adversarial Networks

Optimal Transport (OT) problem aims to find a transport plan that bridges two distributions while minimizing a given cost function. OT theory has been widely utilized in generative modeling. In the beginning, OT distance has been used as a measure for assessing the distance between data and generated distributions. Recently, OT transport map between data and prior distributions has been utilized as a generative model. These OT-based generative models share a similar adversarial training objective. In this paper, we begin by unifying these OT-based adversarial methods within a single framework. Then, we elucidate the role of each component in training dynamics through a comprehensive analysis of this unified framework. Moreover, we suggest a simple but novel method that improves the previously best-performing OT-based model. Intuitively, our approach conducts a gradual refinement of the generated distribution, progressively aligning it with the data distribution. Our approach achieves a FID score of 2.51 on CIFAR-10, outperforming unified OT-based adversarial approaches.

Generative Modeling through the Semi-dual Formulation of Unbalanced Optimal Transport

Optimal Transport (OT) problem investigates a transport map that bridges two distributions while minimizing a given cost function. In this regard, OT between tractable prior distribution and data has been utilized for generative modeling tasks. However, OT-based methods are susceptible to outliers and face optimization challenges during training. In this paper, we propose a novel generative model based on the semi-dual formulation of Unbalanced Optimal Transport (UOT). Unlike OT, UOT relaxes the hard constraint on distribution matching. This approach provides better robustness against outliers, stability during training, and faster convergence. We validate these properties empirically through experiments. Moreover, we study the theoretical upper-bound of divergence between distributions in UOT. Our model outperforms existing OT-based generative models, achieving FID scores of 2.97 on CIFAR-10 and 5.80 on CelebA-HQ-256.

Restoration based Generative Models

Denoising diffusion models (DDMs) have recently attracted increasing attention by showing impressive synthesis quality. DDMs are built on a diffusion process that pushes data to the noise distribution and the models learn to denoise. In this paper, we establish the interpretation of DDMs in terms of image restoration (IR). Integrating IR literature allows us to use an alternative objective and diverse forward processes, not confining to the diffusion process. By imposing prior knowledge on the loss function grounded on MAP-based estimation, we eliminate the need for the expensive sampling of DDMs. Also, we propose a multi-scale training, which improves the performance compared to the diffusion process, by taking advantage of the flexibility of the forward process. Experimental results demonstrate that our model improves the quality and efficiency of both training and inference. Furthermore, we show the applicability of our model to inverse problems. We believe that our framework paves the way for designing a new type of flexible general generative model.

Learning PDE Solution Operator for Continuous Modeling of Time-Series

Learning underlying dynamics from data is important and challenging in many real-world scenarios. Incorporating differential equations (DEs) to design continuous networks has drawn much attention recently, however, most prior works make specific assumptions on the type of DEs, making the model specialized for particular problems. This work presents a partial differential equation (PDE) based framework which improves the dynamics modeling capability. Building upon the recent Fourier neural operator, we propose a neural operator that can handle time continuously without requiring iterative operations or specific grids of temporal discretization. A theoretical result demonstrating its universality is provided. We also uncover an intrinsic property of neural operators that improves data efficiency and model generalization by ensuring stability. Our model achieves superior accuracy in dealing with time-dependent PDEs compared to existing models. Furthermore, several numerical pieces of evidence validate that our method better represents a wide range of dynamics and outperforms state-of-the-art DE-based models in real-time-series applications. Our framework opens up a new way for a continuous representation of neural networks that can be readily adopted for real-world applications.

Robust Out-of-Distribution Detection on Deep Probabilistic Generative Models

Out-of-distribution (OOD) detection is an important task in machine learning systems for ensuring their reliability and safety. Deep probabilistic generative models facilitate OOD detection by estimating the likelihood of a data sample. However, such models frequently assign a suspiciously high likelihood to a specific outlier. Several recent works have addressed this issue by training a neural network with auxiliary outliers, which are generated by perturbing the input data. In this paper, we discover that these approaches fail for certain OOD datasets. Thus, we suggest a new detection metric that operates without outlier exposure. We observe that our metric is robust to diverse variations of an image compared to the previous outlier-exposing methods. Furthermore, our proposed score requires neither auxiliary models nor additional training. Instead, this paper utilizes the likelihood ratio statistic in a new perspective to extract genuine properties from the given single deep probabilistic generative model. We also apply a novel numerical approximation to enable fast implementation. Finally, we demonstrate comprehensive experiments on various probabilistic generative models and show that our method achieves state-of-the-art performance.