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Register a new userLearning Gradient Fields for Shape Generation
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Ruojin Cai
Publication date
2020
fields
Informatics Engineering
and research's language is
English
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In this work, we propose a novel technique to generate shapes from point cloud data. A point cloud can be viewed as samples from a distribution of 3D points whose density is concentrated near the surface of the shape. Point cloud generation thus amounts to moving randomly sampled points to high-density areas. We generate point clouds by performing stochastic gradient ascent on an unnormalized probability density, thereby moving sampled points toward the high-likelihood regions. Our model directly predicts the gradient of the log density field and can be trained with a simple objective adapted from score-based generative models. We show that our method can reach state-of-the-art performance for point cloud auto-encoding and generation, while also allowing for extraction of a high-quality implicit surface. Code is available at https://github.com/RuojinCai/ShapeGF.
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We study a fundamental problem in computational chemistry known as molecular conformation generation, trying to predict stable 3D structures from 2D molecular graphs. Existing machine learning approaches usually first predict distances between atoms and then generate a 3D structure satisfying the distances, where noise in predicted distances may induce extra errors during 3D coordinate generation. Inspired by the traditional force field methods for molecular dynamics simulation, in this paper, we propose a novel approach called ConfGF by directly estimating the gradient fields of the log density of atomic coordinates. The estimated gradient fields allow directly generating stable conformations via Langevin dynamics. However, the problem is very challenging as the gradient fields are roto-translation equivariant. We notice that estimating the gradient fields of atomic coordinates can be translated to estimating the gradient fields of interatomic distances, and hence develop a novel algorithm based on recent score-based generative models to effectively estimate these gradients. Experimental results across multiple tasks show that ConfGF outperforms previous state-of-the-art baselines by a significant margin.
We investigate the problem of learning category-specific 3D shape reconstruction from a variable number of RGB views of previously unobserved object instances. Most approaches for multiview shape reconstruction operate on sparse shape representations, or assume a fixed number of views. We present a method that can estimate dense 3D shape, and aggregate shape across multiple and varying number of input views. Given a single input view of an object instance, we propose a representation that encodes the dense shape of the visible object surface as well as the surface behind line of sight occluded by the visible surface. When multiple input views are available, the shape representation is designed to be aggregated into a single 3D shape using an inexpensive union operation. We train a 2D CNN to learn to predict this representation from a variable number of views (1 or more). We further aggregate multiview information by using permutation equivariant layers that promote order-agnostic view information exchange at the feature level. Experiments show that our approach is able to produce dense 3D reconstructions of objects that improve in quality as more views are added.
Human beings can quickly adapt to environmental changes by leveraging learning experience. However, the poor ability of adapting to dynamic environments remains a major challenge for AI models. To better understand this issue, we study the problem of continual domain adaptation, where the model is presented with a labeled source domain and a sequence of unlabeled target domains. There are two major obstacles in this problem: domain shifts and catastrophic forgetting. In this work, we propose Gradient Regularized Contrastive Learning to solve the above obstacles. At the core of our method, gradient regularization plays two key roles: (1) enforces the gradient of contrastive loss not to increase the supervised training loss on the source domain, which maintains the discriminative power of learned features; (2) regularizes the gradient update on the new domain not to increase the classification loss on the old target domains, which enables the model to adapt to an in-coming target domain while preserving the performance of previously observed domains. Hence our method can jointly learn both semantically discriminative and domain-invariant features with labeled source domain and unlabeled target domains. The experiments on Digits, DomainNet and Office-Caltech benchmarks demonstrate the strong performance of our approach when compared to the state-of-the-art.
Conditional image generation is the task of generating diverse images using class label information. Although many conditional Generative Adversarial Networks (GAN) have shown realistic results, such methods consider pairwise relations between the embedding of an image and the embedding of the corresponding label (data-to-class relations) as the conditioning losses. In this paper, we propose ContraGAN that considers relations between multiple image embeddings in the same batch (data-to-data relations) as well as the data-to-class relations by using a conditional contrastive loss. The discriminator of ContraGAN discriminates the authenticity of given samples and minimizes a contrastive objective to learn the relations between training images. Simultaneously, the generator tries to generate realistic images that deceive the authenticity and have a low contrastive loss. The experimental results show that ContraGAN outperforms state-of-the-art-models by 7.3% and 7.7% on Tiny ImageNet and ImageNet datasets, respectively. Besides, we experimentally demonstrate that contrastive learning helps to relieve the overfitting of the discriminator. For a fair comparison, we re-implement twelve state-of-the-art GANs using the PyTorch library. The software package is available at https://github.com/POSTECH-CVLab/PyTorch-StudioGAN.
Prior gradient-based attribution-map methods rely on handcrafted propagation rules for the non-linear/activation layers during the backward pass, so as to produce gradients of the input and then the attribution map. Despite the promising results achieved, such methods are sensitive to the non-informative high-frequency components and lack adaptability for various models and samples. In this paper, we propose a dedicated method to generate attribution maps that allow us to learn the propagation rules automatically, overcoming the flaws of the handcrafted ones. Specifically, we introduce a learnable plugin module, which enables adaptive propagation rules for each pixel, to the non-linear layers during the backward pass for mask generating. The masked input image is then fed into the model again to obtain new output that can be used as a guidance when combined with the original one. The introduced learnable module can be trained under any auto-grad framework with higher-order differential support. As demonstrated on five datasets and six network architectures, the proposed method yields state-of-the-art results and gives cleaner and more visually plausible attribution maps.
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