Graph Neural Networks are Inherently Good Generalizers: Insights by Bridging GNNs and MLPs

Graph neural networks (GNNs), as the de-facto model class for representation learning on graphs, are built upon the multi-layer perceptrons (MLP) architecture with additional message passing layers to allow features to flow across nodes. While conventional wisdom largely attributes the success of GNNs to their advanced expressivity for learning desired functions on nodes' ego-graphs, we conjecture that this is \emph{not} the main cause of GNNs' superiority in node prediction tasks. This paper pinpoints the major source of GNNs' performance gain to their intrinsic generalization capabilities, by introducing an intermediate model class dubbed as P(ropagational)MLP, which is identical to standard MLP in training, and then adopt GNN's architecture in testing. Intriguingly, we observe that PMLPs consistently perform on par with (or even exceed) their GNN counterparts across ten benchmarks and different experimental settings, despite the fact that PMLPs share the same (trained) weights with poorly-performed MLP. This critical finding opens a door to a brand new perspective for understanding the power of GNNs, and allow bridging GNNs and MLPs for dissecting their generalization behaviors. As an initial step to analyze PMLP, we show its essential difference with MLP at infinite-width limit lies in the NTK feature map in the post-training stage. Moreover, though MLP and PMLP cannot extrapolate non-linear functions for extreme OOD data, PMLP has more freedom to generalize near the training support.

Localized Contrastive Learning on Graphs

Contrastive learning methods based on InfoNCE loss are popular in node representation learning tasks on graph-structured data. However, its reliance on data augmentation and its quadratic computational complexity might lead to inconsistency and inefficiency problems. To mitigate these limitations, in this paper, we introduce a simple yet effective contrastive model named Localized Graph Contrastive Learning (Local-GCL in short). Local-GCL consists of two key designs: 1) We fabricate the positive examples for each node directly using its first-order neighbors, which frees our method from the reliance on carefully-designed graph augmentations; 2) To improve the efficiency of contrastive learning on graphs, we devise a kernelized contrastive loss, which could be approximately computed in linear time and space complexity with respect to the graph size. We provide theoretical analysis to justify the effectiveness and rationality of the proposed methods. Experiments on various datasets with different scales and properties demonstrate that in spite of its simplicity, Local-GCL achieves quite competitive performance in self-supervised node representation learning tasks on graphs with various scales and properties.

Leveraging Angular Information Between Feature and Classifier for Long-tailed Learning: A Prediction Reformulation Approach

Deep neural networks still struggle on long-tailed image datasets, and one of the reasons is that the imbalance of training data across categories leads to the imbalance of trained model parameters. Motivated by the empirical findings that trained classifiers yield larger weight norms in head classes, we propose to reformulate the recognition probabilities through included angles without re-balancing the classifier weights. Specifically, we calculate the angles between the data feature and the class-wise classifier weights to obtain angle-based prediction results. Inspired by the performance improvement of the predictive form reformulation and the outstanding performance of the widely used two-stage learning framework, we explore the different properties of this angular prediction and propose novel modules to improve the performance of different components in the framework. Our method is able to obtain the best performance among peer methods without pretraining on CIFAR10/100-LT and ImageNet-LT. Source code will be made publicly available.

Geometric Knowledge Distillation: Topology Compression for Graph Neural Networks

We study a new paradigm of knowledge transfer that aims at encoding graph topological information into graph neural networks (GNNs) by distilling knowledge from a teacher GNN model trained on a complete graph to a student GNN model operating on a smaller or sparser graph. To this end, we revisit the connection between thermodynamics and the behavior of GNN, based on which we propose Neural Heat Kernel (NHK) to encapsulate the geometric property of the underlying manifold concerning the architecture of GNNs. A fundamental and principled solution is derived by aligning NHKs on teacher and student models, dubbed as Geometric Knowledge Distillation. We develop non- and parametric instantiations and demonstrate their efficacy in various experimental settings for knowledge distillation regarding different types of privileged topological information and teacher-student schemes.

Towards Out-of-Distribution Sequential Event Prediction: A Causal Treatment

The goal of sequential event prediction is to estimate the next event based on a sequence of historical events, with applications to sequential recommendation, user behavior analysis and clinical treatment. In practice, the next-event prediction models are trained with sequential data collected at one time and need to generalize to newly arrived sequences in remote future, which requires models to handle temporal distribution shift from training to testing. In this paper, we first take a data-generating perspective to reveal a negative result that existing approaches with maximum likelihood estimation would fail for distribution shift due to the latent context confounder, i.e., the common cause for the historical events and the next event. Then we devise a new learning objective based on backdoor adjustment and further harness variational inference to make it tractable for sequence learning problems. On top of that, we propose a framework with hierarchical branching structures for learning context-specific representations. Comprehensive experiments on diverse tasks (e.g., sequential recommendation) demonstrate the effectiveness, applicability and scalability of our method with various off-the-shelf models as backbones.

Learning Universe Model for Partial Matching Networks over Multiple Graphs

We consider the general setting for partial matching of two or multiple graphs, in the sense that not necessarily all the nodes in one graph can find their correspondences in another graph and vice versa. We take a universe matching perspective to this ubiquitous problem, whereby each node is either matched into an anchor in a virtual universe graph or regarded as an outlier. Such a universe matching scheme enjoys a few important merits, which have not been adopted in existing learning-based graph matching (GM) literature. First, the subtle logic for inlier matching and outlier detection can be clearly modeled, which is otherwise less convenient to handle in the pairwise matching scheme. Second, it enables end-to-end learning especially for universe level affinity metric learning for inliers matching, and loss design for gathering outliers together. Third, the resulting matching model can easily handle new arriving graphs under online matching, or even the graphs coming from different categories of the training set. To our best knowledge, this is the first deep learning network that can cope with two-graph matching, multiple-graph matching, online matching, and mixture graph matching simultaneously. Extensive experimental results show the state-of-the-art performance of our method in these settings.

H2RBox: Horizonal Box Annotation is All You Need for Oriented Object Detection

Oriented object detection emerges in many applications from aerial images to autonomous driving, while many existing detection benchmarks are annotated with horizontal bounding box only which is also less costive than fine-grained rotated box, leading to a gap between the readily available training corpus and the rising demand for oriented object detection. This paper proposes a simple yet effective oriented object detection approach called H2RBox merely using horizontal box annotation for weakly-supervised training, which closes the above gap and shows competitive performance even against those trained with rotated boxes. The cores of our method are weakly- and self-supervised learning, which predicts the angle of the object by learning the consistency of two different views. To our best knowledge, H2RBox is the first horizontal box annotation-based oriented object detector. Compared to an alternative i.e. horizontal box-supervised instance segmentation with our post adaption to oriented object detection, our approach is not susceptible to the prediction quality of mask and can perform more robustly in complex scenes containing a large number of dense objects and outliers. Experimental results show that H2RBox has significant performance and speed advantages over horizontal box-supervised instance segmentation methods, as well as lower memory requirements. While compared to rotated box-supervised oriented object detectors, our method shows very close performance and speed, and even surpasses them in some cases. The source code is available at https://github.com/yangxue0827/h2rbox-mmrotate.

Detecting Rotated Objects as Gaussian Distributions and Its 3-D Generalization

Existing detection methods commonly use a parameterized bounding box (BBox) to model and detect (horizontal) objects and an additional rotation angle parameter is used for rotated objects. We argue that such a mechanism has fundamental limitations in building an effective regression loss for rotation detection, especially for high-precision detection with high IoU (e.g. 0.75). Instead, we propose to model the rotated objects as Gaussian distributions. A direct advantage is that our new regression loss regarding the distance between two Gaussians e.g. Kullback-Leibler Divergence (KLD), can well align the actual detection performance metric, which is not well addressed in existing methods. Moreover, the two bottlenecks i.e. boundary discontinuity and square-like problem also disappear. We also propose an efficient Gaussian metric-based label assignment strategy to further boost the performance. Interestingly, by analyzing the BBox parameters' gradients under our Gaussian-based KLD loss, we show that these parameters are dynamically updated with interpretable physical meaning, which help explain the effectiveness of our approach, especially for high-precision detection. We extend our approach from 2-D to 3-D with a tailored algorithm design to handle the heading estimation, and experimental results on twelve public datasets (2-D/3-D, aerial/text/face images) with various base detectors show its superiority.

Delving into the Devils of Bird's-eye-view Perception: A Review, Evaluation and Recipe

Learning powerful representations in bird's-eye-view (BEV) for perception tasks is trending and drawing extensive attention both from industry and academia. Conventional approaches for most autonomous driving algorithms perform detection, segmentation, tracking, etc., in a front or perspective view. As sensor configurations get more complex, integrating multi-source information from different sensors and representing features in a unified view come of vital importance. BEV perception inherits several advantages, as representing surrounding scenes in BEV is intuitive and fusion-friendly; and representing objects in BEV is most desirable for subsequent modules as in planning and/or control. The core problems for BEV perception lie in (a) how to reconstruct the lost 3D information via view transformation from perspective view to BEV; (b) how to acquire ground truth annotations in BEV grid; (c) how to formulate the pipeline to incorporate features from different sources and views; and (d) how to adapt and generalize algorithms as sensor configurations vary across different scenarios. In this survey, we review the most recent work on BEV perception and provide an in-depth analysis of different solutions. Moreover, several systematic designs of BEV approach from the industry are depicted as well. Furthermore, we introduce a full suite of practical guidebook to improve the performance of BEV perception tasks, including camera, LiDAR and fusion inputs. At last, we point out the future research directions in this area. We hope this report would shed some light on the community and encourage more research effort on BEV perception. We keep an active repository to collect the most recent work and provide a toolbox for bag of tricks at https://github.com/OpenPerceptionX/BEVPerception-Survey-Recipe.

ST-P3: End-to-end Vision-based Autonomous Driving via Spatial-Temporal Feature Learning

Many existing autonomous driving paradigms involve a multi-stage discrete pipeline of tasks. To better predict the control signals and enhance user safety, an end-to-end approach that benefits from joint spatial-temporal feature learning is desirable. While there are some pioneering works on LiDAR-based input or implicit design, in this paper we formulate the problem in an interpretable vision-based setting. In particular, we propose a spatial-temporal feature learning scheme towards a set of more representative features for perception, prediction and planning tasks simultaneously, which is called ST-P3. Specifically, an egocentric-aligned accumulation technique is proposed to preserve geometry information in 3D space before the bird's eye view transformation for perception; a dual pathway modeling is devised to take past motion variations into account for future prediction; a temporal-based refinement unit is introduced to compensate for recognizing vision-based elements for planning. To the best of our knowledge, we are the first to systematically investigate each part of an interpretable end-to-end vision-based autonomous driving system. We benchmark our approach against previous state-of-the-arts on both open-loop nuScenes dataset as well as closed-loop CARLA simulation. The results show the effectiveness of our method. Source code, model and protocol details are made publicly available at https://github.com/OpenPerceptionX/ST-P3.