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Abstract Representations of the world environment play a crucial role in artificial intelligence. It is often inefficient to conduct reasoning and inference directly in the space of raw sensory representations, such as pixel values of images. Representation learning allows us to automatically discover suitable representations from raw sensory data. For example, given raw sensory data, a deep neural network learns nonlinear representations at its hidden layers, which are subsequently used for classification (or regression) at its output layer. This happens implicitly during training through minimizing a supervised or unsupervised loss. In this letter, we study the dynamics of such implicit nonlinear representation learning. We identify a pair of a new assumption and a novel condition, called the on-model structure assumption and the data architecture alignment condition. Under the on-model structure assumption, the data architecture alignment condition is shown to be sufficient for the global convergence and necessary for global optimality. Moreover, our theory explains how and when increasing network size does and does not improve the training behaviors in the practical regime. Our results provide practical guidance for designing a model structure; for example, the on-model structure assumption can be used as a justification for using a particular model structure instead of others. As an application, we then derive a new training framework, which satisfies the data architecture alignment condition without assuming it by automatically modifying any given training algorithm dependent on data and architecture. Given a standard training algorithm, the framework running its modified version is empirically shown to maintain competitive (practical) test performances while providing global convergence guarantees for deep residual neural networks with convolutions, skip connections, and batch normalization with standard benchmark data sets, including MNIST, CIFAR-10, CIFAR-100, Semeion, KMNIST, and SVHN. 

Graph Neural Networks (GNNs) have been studied through the lens of expressive power and generalization. However, their optimization properties are less well understood. We take the first step towards analyzing GNN training by studying the gradient dynamics of GNNs. First, we analyze linearized GNNs and prove that despite the non-convexity of training, convergence to a global minimum at a linear rate is guaranteed under mild assumptions that we validate on real-world graphs. Second, we study what may affect the GNNs’ training speed. Our results show that the training of GNNs is implicitly accelerated by skip connections, more depth, and/or a good label distribution. Empirical results confirm that our theoretical results for linearized GNNs align with the training behavior of nonlinear GNNs. Our results provide the first theoretical support for the success of GNNs with skip connections in terms of optimization, and suggest that deep GNNs with skip connections would be promising in practice.