arXiv subjects

David Wipf

Publications and source records attributed to David Wipf.

At least 55 records · Page 3Linked to original sources

arXiv2022

A Robust Stacking Framework for Training Deep Graph Models with Multifaceted Node Features

Graph Neural Networks (GNNs) with numerical node features and graph structure as inputs have demonstrated superior performance on various supervised learning tasks with graph data. However the numerical node features utilized by GNNs are commonly extracted from raw data which is of text or tabular (numeric/categorical) type in most real-world applications. The best models for such data types in most standard supervised learning settings with IID (non-graph) data are not simple neural network layers and thus are not easily incorporated into a GNN. Here we propose a robust stacking framework that fuses graph-aware propagation with arbitrary models intended for IID data, which are ensembled and stacked in multiple layers. Our layer-wise framework leverages bagging and stacking strategies to enjoy strong generalization, in a manner which effectively mitigates label leakage and overfitting. Across a variety of graph datasets with tabular/text node features, our method achieves comparable or superior performance relative to both tabular/text and graph neural network models, as well as existing state-of-the-art hybrid strategies that combine the two.

cs.LG↗

arXiv2022

Learning Enhanced Representations for Tabular Data via Neighborhood Propagation

Prediction over tabular data is an essential and fundamental problem in many important downstream tasks. However, existing methods either take a data instance of the table independently as input or do not fully utilize the multi-rows features and labels to directly change and enhance the target data representations. In this paper, we propose to 1) construct a hypergraph from relevant data instance retrieval to model the cross-row and cross-column patterns of those instances, and 2) perform message Propagation to Enhance the target data instance representation for Tabular prediction tasks. Specifically, our specially-designed message propagation step benefits from 1) fusion of label and features during propagation, and 2) locality-aware high-order feature interactions. Experiments on two important tabular data prediction tasks validate the superiority of the proposed PET model against other baselines. Additionally, we demonstrate the effectiveness of the model components and the feature enhancement ability of PET via various ablation studies and visualizations. The code is included in https://github.com/KounianhuaDu/PET.

cs.LG↗

arXiv2021

Graph Neural Networks Inspired by Classical Iterative Algorithms

Despite the recent success of graph neural networks (GNN), common architectures often exhibit significant limitations, including sensitivity to oversmoothing, long-range dependencies, and spurious edges, e.g., as can occur as a result of graph heterophily or adversarial attacks. To at least partially address these issues within a simple transparent framework, we consider a new family of GNN layers designed to mimic and integrate the update rules of two classical iterative algorithms, namely, proximal gradient descent and iterative reweighted least squares (IRLS). The former defines an extensible base GNN architecture that is immune to oversmoothing while nonetheless capturing long-range dependencies by allowing arbitrary propagation steps. In contrast, the latter produces a novel attention mechanism that is explicitly anchored to an underlying end-to-end energy function, contributing stability with respect to edge uncertainty. When combined we obtain an extremely simple yet robust model that we evaluate across disparate scenarios including standardized benchmarks, adversarially-perturbated graphs, graphs with heterophily, and graphs involving long-range dependencies. In doing so, we compare against SOTA GNN approaches that have been explicitly designed for the respective task, achieving competitive or superior node classification accuracy. Our code is available at https://github.com/FFTYYY/TWIRLS.

cs.LG↗

arXiv2021

A Biased Graph Neural Network Sampler with Near-Optimal Regret

Graph neural networks (GNN) have recently emerged as a vehicle for applying deep network architectures to graph and relational data. However, given the increasing size of industrial datasets, in many practical situations the message passing computations required for sharing information across GNN layers are no longer scalable. Although various sampling methods have been introduced to approximate full-graph training within a tractable budget, there remain unresolved complications such as high variances and limited theoretical guarantees. To address these issues, we build upon existing work and treat GNN neighbor sampling as a multi-armed bandit problem but with a newly-designed reward function that introduces some degree of bias designed to reduce variance and avoid unstable, possibly-unbounded pay outs. And unlike prior bandit-GNN use cases, the resulting policy leads to near-optimal regret while accounting for the GNN training dynamics introduced by SGD. From a practical standpoint, this translates into lower variance estimates and competitive or superior test accuracy across several benchmarks.

cs.LG↗

arXiv2021

From Canonical Correlation Analysis to Self-supervised Graph Neural Networks

We introduce a conceptually simple yet effective model for self-supervised representation learning with graph data. It follows the previous methods that generate two views of an input graph through data augmentation. However, unlike contrastive methods that focus on instance-level discrimination, we optimize an innovative feature-level objective inspired by classical Canonical Correlation Analysis. Compared with other works, our approach requires none of the parameterized mutual information estimator, additional projector, asymmetric structures, and most importantly, negative samples which can be costly. We show that the new objective essentially 1) aims at discarding augmentation-variant information by learning invariant representations, and 2) can prevent degenerated solutions by decorrelating features in different dimensions. Our theoretical analysis further provides an understanding for the new objective which can be equivalently seen as an instantiation of the Information Bottleneck Principle under the self-supervised setting. Despite its simplicity, our method performs competitively on seven public graph datasets. The code is available at: https://github.com/hengruizhang98/CCA-SSG.

cs.LG↗

arXiv2021

Bag of Tricks for Node Classification with Graph Neural Networks

Over the past few years, graph neural networks (GNN) and label propagation-based methods have made significant progress in addressing node classification tasks on graphs. However, in addition to their reliance on elaborate architectures and algorithms, there are several key technical details that are frequently overlooked, and yet nonetheless can play a vital role in achieving satisfactory performance. In this paper, we first summarize a series of existing tricks-of-the-trade, and then propose several new ones related to label usage, loss function formulation, and model design that can significantly improve various GNN architectures. We empirically evaluate their impact on final node classification accuracy by conducting ablation studies and demonstrate consistently-improved performance, often to an extent that outweighs the gains from more dramatic changes in the underlying GNN architecture. Notably, many of the top-ranked models on the Open Graph Benchmark (OGB) leaderboard and KDDCUP 2021 Large-Scale Challenge MAG240M-LSC benefit from these techniques we initiated.

cs.LG↗

arXiv2021

Why Propagate Alone? Parallel Use of Labels and Features on Graphs

Graph neural networks (GNNs) and label propagation represent two interrelated modeling strategies designed to exploit graph structure in tasks such as node property prediction. The former is typically based on stacked message-passing layers that share neighborhood information to transform node features into predictive embeddings. In contrast, the latter involves spreading label information to unlabeled nodes via a parameter-free diffusion process, but operates independently of the node features. Given then that the material difference is merely whether features or labels are smoothed across the graph, it is natural to consider combinations of the two for improving performance. In this regard, it has recently been proposed to use a randomly-selected portion of the training labels as GNN inputs, concatenated with the original node features for making predictions on the remaining labels. This so-called label trick accommodates the parallel use of features and labels, and is foundational to many of the top-ranking submissions on the Open Graph Benchmark (OGB) leaderboard. And yet despite its wide-spread adoption, thus far there has been little attempt to carefully unpack exactly what statistical properties the label trick introduces into the training pipeline, intended or otherwise. To this end, we prove that under certain simplifying assumptions, the stochastic label trick can be reduced to an interpretable, deterministic training objective composed of two factors. The first is a data-fitting term that naturally resolves potential label leakage issues, while the second serves as a regularization factor conditioned on graph structure that adapts to graph size and connectivity. Later, we leverage this perspective to motivate a broader range of label trick use cases, and provide experiments to verify the efficacy of these extensions.

cs.LG↗

arXiv2021

Learning Hierarchical Graph Neural Networks for Image Clustering

We propose a hierarchical graph neural network (GNN) model that learns how to cluster a set of images into an unknown number of identities using a training set of images annotated with labels belonging to a disjoint set of identities. Our hierarchical GNN uses a novel approach to merge connected components predicted at each level of the hierarchy to form a new graph at the next level. Unlike fully unsupervised hierarchical clustering, the choice of grouping and complexity criteria stems naturally from supervision in the training set. The resulting method, Hi-LANDER, achieves an average of 54% improvement in F-score and 8% increase in Normalized Mutual Information (NMI) relative to current GNN-based clustering algorithms. Additionally, state-of-the-art GNN-based methods rely on separate models to predict linkage probabilities and node densities as intermediate steps of the clustering process. In contrast, our unified framework achieves a seven-fold decrease in computational cost. We release our training and inference code at https://github.com/dmlc/dgl/tree/master/examples/pytorch/hilander.

cs.CV↗

arXiv2021

Fork or Fail: Cycle-Consistent Training with Many-to-One Mappings

Cycle-consistent training is widely used for jointly learning a forward and inverse mapping between two domains of interest without the cumbersome requirement of collecting matched pairs within each domain. In this regard, the implicit assumption is that there exists (at least approximately) a ground-truth bijection such that a given input from either domain can be accurately reconstructed from successive application of the respective mappings. But in many applications no such bijection can be expected to exist and large reconstruction errors can compromise the success of cycle-consistent training. As one important instance of this limitation, we consider practically-relevant situations where there exists a many-to-one or surjective mapping between domains. To address this regime, we develop a conditional variational autoencoder (CVAE) approach that can be viewed as converting surjective mappings to implicit bijections whereby reconstruction errors in both directions can be minimized, and as a natural byproduct, realistic output diversity can be obtained in the one-to-many direction. As theoretical motivation, we analyze a simplified scenario whereby minima of the proposed CVAE-based energy function align with the recovery of ground-truth surjective mappings. On the empirical side, we consider a synthetic image dataset with known ground-truth, as well as a real-world application involving natural language generation from knowledge graphs and vice versa, a prototypical surjective case. For the latter, our CVAE pipeline can capture such many-to-one mappings during cycle training while promoting textural diversity for graph-to-text tasks. Our code is available at github.com/QipengGuo/CycleGT *A condensed version of this paper has been accepted to AISTATS 2021. This version contains additional content and updates.

cs.LG↗

arXiv2020

CycleGT: Unsupervised Graph-to-Text and Text-to-Graph Generation via Cycle Training

Two important tasks at the intersection of knowledge graphs and natural language processing are graph-to-text (G2T) and text-to-graph (T2G) conversion. Due to the difficulty and high cost of data collection, the supervised data available in the two fields are usually on the magnitude of tens of thousands, for example, 18K in the WebNLG~2017 dataset after preprocessing, which is far fewer than the millions of data for other tasks such as machine translation. Consequently, deep learning models for G2T and T2G suffer largely from scarce training data. We present CycleGT, an unsupervised training method that can bootstrap from fully non-parallel graph and text data, and iteratively back translate between the two forms. Experiments on WebNLG datasets show that our unsupervised model trained on the same number of data achieves performance on par with several fully supervised models. Further experiments on the non-parallel GenWiki dataset verify that our method performs the best among unsupervised baselines. This validates our framework as an effective approach to overcome the data scarcity problem in the fields of G2T and T2G. Our code is available at https://github.com/QipengGuo/CycleGT.

cs.CL↗

arXiv2020

Further Analysis of Outlier Detection with Deep Generative Models

The recent, counter-intuitive discovery that deep generative models (DGMs) can frequently assign a higher likelihood to outliers has implications for both outlier detection applications as well as our overall understanding of generative modeling. In this work, we present a possible explanation for this phenomenon, starting from the observation that a model's typical set and high-density region may not conincide. From this vantage point we propose a novel outlier test, the empirical success of which suggests that the failure of existing likelihood-based outlier tests does not necessarily imply that the corresponding generative model is uncalibrated. We also conduct additional experiments to help disentangle the impact of low-level texture versus high-level semantics in differentiating outliers. In aggregate, these results suggest that modifications to the standard evaluation practices and benchmarks commonly applied in the literature are needed.

stat.ML↗

arXiv2019

The Usual Suspects? Reassessing Blame for VAE Posterior Collapse

In narrow asymptotic settings Gaussian VAE models of continuous data have been shown to possess global optima aligned with ground-truth distributions. Even so, it is well known that poor solutions whereby the latent posterior collapses to an uninformative prior are sometimes obtained in practice. However, contrary to conventional wisdom that largely assigns blame for this phenomena on the undue influence of KL-divergence regularization, we will argue that posterior collapse is, at least in part, a direct consequence of bad local minima inherent to the loss surface of deep autoencoder networks. In particular, we prove that even small nonlinear perturbations of affine VAE decoder models can produce such minima, and in deeper models, analogous minima can force the VAE to behave like an aggressive truncation operator, provably discarding information along all latent dimensions in certain circumstances. Regardless, the underlying message here is not meant to undercut valuable existing explanations of posterior collapse, but rather, to refine the discussion and elucidate alternative risk factors that may have been previously underappreciated.

cs.LG↗

arXiv2019

Diagnosing and Enhancing VAE Models

Although variational autoencoders (VAEs) represent a widely influential deep generative model, many aspects of the underlying energy function remain poorly understood. In particular, it is commonly believed that Gaussian encoder/decoder assumptions reduce the effectiveness of VAEs in generating realistic samples. In this regard, we rigorously analyze the VAE objective, differentiating situations where this belief is and is not actually true. We then leverage the corresponding insights to develop a simple VAE enhancement that requires no additional hyperparameters or sensitive tuning. Quantitatively, this proposal produces crisp samples and stable FID scores that are actually competitive with a variety of GAN models, all while retaining desirable attributes of the original VAE architecture. A shorter version of this work will appear in the ICLR 2019 conference proceedings (Dai and Wipf, 2019). The code for our model is available at https://github.com/daib13/ TwoStageVAE.

cs.LG↗

arXiv2019

Hidden Talents of the Variational Autoencoder

Variational autoencoders (VAE) represent a popular, flexible form of deep generative model that can be stochastically fit to samples from a given random process using an information-theoretic variational bound on the true underlying distribution. Once so-obtained, the model can be putatively used to generate new samples from this distribution, or to provide a low-dimensional latent representation of existing samples. While quite effective in numerous application domains, certain important mechanisms which govern the behavior of the VAE are obfuscated by the intractable integrals and resulting stochastic approximations involved. Moreover, as a highly non-convex model, it remains unclear exactly how minima of the underlying energy relate to original design purposes. We attempt to better quantify these issues by analyzing a series of tractable special cases of increasing complexity. In doing so, we unveil interesting connections with more traditional dimensionality reduction models, as well as an intrinsic yet underappreciated propensity for robustly dismissing sparse outliers when estimating latent manifolds. With respect to the latter, we demonstrate that the VAE can be viewed as the natural evolution of recent robust PCA models, capable of learning nonlinear manifolds of unknown dimension obscured by gross corruptions.

cs.LG↗

arXiv2019

Single Image Reflection Removal Exploiting Misaligned Training Data and Network Enhancements

Removing undesirable reflections from a single image captured through a glass window is of practical importance to visual computing systems. Although state-of-the-art methods can obtain decent results in certain situations, performance declines significantly when tackling more general real-world cases. These failures stem from the intrinsic difficulty of single image reflection removal -- the fundamental ill-posedness of the problem, and the insufficiency of densely-labeled training data needed for resolving this ambiguity within learning-based neural network pipelines. In this paper, we address these issues by exploiting targeted network enhancements and the novel use of misaligned data. For the former, we augment a baseline network architecture by embedding context encoding modules that are capable of leveraging high-level contextual clues to reduce indeterminacy within areas containing strong reflections. For the latter, we introduce an alignment-invariant loss function that facilitates exploiting misaligned real-world training data that is much easier to collect. Experimental results collectively show that our method outperforms the state-of-the-art with aligned data, and that significant improvements are possible when using additional misaligned data.

cs.CV↗

arXiv2018

Image Smoothing via Unsupervised Learning

Image smoothing represents a fundamental component of many disparate computer vision and graphics applications. In this paper, we present a unified unsupervised (label-free) learning framework that facilitates generating flexible and high-quality smoothing effects by directly learning from data using deep convolutional neural networks (CNNs). The heart of the design is the training signal as a novel energy function that includes an edge-preserving regularizer which helps maintain important yet potentially vulnerable image structures, and a spatially-adaptive Lp flattening criterion which imposes different forms of regularization onto different image regions for better smoothing quality. We implement a diverse set of image smoothing solutions employing the unified framework targeting various applications such as, image abstraction, pencil sketching, detail enhancement, texture removal and content-aware image manipulation, and obtain results comparable with or better than previous methods. Moreover, our method is extremely fast with a modern GPU (e.g, 200 fps for 1280x720 images). Our codes and model are released in https://github.com/fqnchina/ImageSmoothing.

cs.CV↗

arXiv2018

Revisiting Deep Intrinsic Image Decompositions

While invaluable for many computer vision applications, decomposing a natural image into intrinsic reflectance and shading layers represents a challenging, underdetermined inverse problem. As opposed to strict reliance on conventional optimization or filtering solutions with strong prior assumptions, deep learning based approaches have also been proposed to compute intrinsic image decompositions when granted access to sufficient labeled training data. The downside is that current data sources are quite limited, and broadly speaking fall into one of two categories: either dense fully-labeled images in synthetic/narrow settings, or weakly-labeled data from relatively diverse natural scenes. In contrast to many previous learning-based approaches, which are often tailored to the structure of a particular dataset (and may not work well on others), we adopt core network structures that universally reflect loose prior knowledge regarding the intrinsic image formation process and can be largely shared across datasets. We then apply flexibly supervised loss layers that are customized for each source of ground truth labels. The resulting deep architecture achieves state-of-the-art results on all of the major intrinsic image benchmarks, and runs considerably faster than most at test time.

cs.CV↗

arXiv2018

A Generic Deep Architecture for Single Image Reflection Removal and Image Smoothing

This paper proposes a deep neural network structure that exploits edge information in addressing representative low-level vision tasks such as layer separation and image filtering. Unlike most other deep learning strategies applied in this context, our approach tackles these challenging problems by estimating edges and reconstructing images using only cascaded convolutional layers arranged such that no handcrafted or application-specific image-processing components are required. We apply the resulting transferrable pipeline to two different problem domains that are both sensitive to edges, namely, single image reflection removal and image smoothing. For the former, using a mild reflection smoothness assumption and a novel synthetic data generation method that acts as a type of weak supervision, our network is able to solve much more difficult reflection cases that cannot be handled by previous methods. For the latter, we also exceed the state-of-the-art quantitative and qualitative results by wide margins. In all cases, the proposed framework is simple, fast, and easy to transfer across disparate domains.

cs.CV↗