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The popularity of deep convolutional autoencoders (CAEs) has engendered new and effective reduced-order models (ROMs) for the simulation of large-scale dynamical systems. Despite this, it is still unknown whether deep CAEs provide superior performance over established linear techniques or other network-based methods in all modeling scenarios. To elucidate this, the effect of autoencoder architecture on its associated ROM is studied through the comparison of deep CAEs against two alternatives: a simple fully connected autoencoder, and a novel graph convolutional autoencoder. Through benchmark experiments, it is shown that the superior autoencoder architecture for a given ROM application is highly dependent on the size of the latent space and the structure of the snapshot data, with the proposed architecture demonstrating benefits on data with irregular connectivity when the latent space is sufficiently large.

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自(zi)動(dong)編碼(ma)(ma)(ma)器是一種人(ren)工神(shen)經網絡,用于以無監督(du)的方(fang)式學習(xi)有(you)(you)效的數據編碼(ma)(ma)(ma)。自(zi)動(dong)編碼(ma)(ma)(ma)器的目的是通過訓練網絡忽略信號(hao)“噪聲”來學習(xi)一組數據的表示(shi)(編碼(ma)(ma)(ma)),通常(chang)用于降維(wei)。與(yu)簡化(hua)方(fang)面(mian)一起,學習(xi)了(le)重(zhong)構方(fang)面(mian),在(zai)此,自(zi)動(dong)編碼(ma)(ma)(ma)器嘗(chang)試從(cong)簡化(hua)編碼(ma)(ma)(ma)中生成(cheng)盡可能接近其(qi)原始輸(shu)(shu)入(ru)的表示(shi)形(xing)式,從(cong)而得到(dao)其(qi)名稱。基(ji)本模型存在(zai)幾種變體,其(qi)目的是迫(po)使學習(xi)的輸(shu)(shu)入(ru)表示(shi)形(xing)式具有(you)(you)有(you)(you)用的屬性。自(zi)動(dong)編碼(ma)(ma)(ma)器可有(you)(you)效地解決許多應用問題,從(cong)面(mian)部識別到(dao)獲取單詞(ci)的語義。

Anomaly detection among a large number of processes arises in many applications ranging from dynamic spectrum access to cybersecurity. In such problems one can often obtain noisy observations aggregated from a chosen subset of processes that conforms to a tree structure. The distribution of these observations, based on which the presence of anomalies is detected, may be only partially known. This gives rise to the need for a search strategy designed to account for both the sample complexity and the detection accuracy, as well as cope with statistical models that are known only up to some missing parameters. In this work we propose a sequential search strategy using two variations of the Generalized Local Likelihood Ratio statistic. Our proposed Hierarchical Dynamic Search (HDS) strategy is shown to be order-optimal with respect to the size of the search space and asymptotically optimal with respect to the detection accuracy. An explicit upper bound on the error probability of HDS is established for the finite sample regime. Extensive experiments are conducted, demonstrating the performance gains of HDS over existing methods.

The square kernel is a standard unit for contemporary CNNs, as it fits well on the tensor computation for convolution operation. However, the retinal ganglion cells in the biological visual system have approximately concentric receptive fields. Motivated by this observation, we propose to use circular kernel with a concentric and isotropic receptive field as an option for the convolution operation. We first propose a simple yet efficient implementation of the convolution using circular kernels, and empirically show the significant advantages of large circular kernels over the counterpart square kernels. We then expand the operation space of several typical Neural Architecture Search (NAS) methods with the convolutions of large circular kernels. The searched new neural architectures do contain large circular kernels and outperform the original searched models considerably. Our additional analysis also reveals that large circular kernels could help the model to be more robust to the rotated or sheared images due to their better rotation invariance. Our work shows the potential of designing new convolutional kernels for CNNs, bringing up the prospect of expanding the search space of NAS with new variants of convolutions.

While neural architecture search (NAS) has enabled automated machine learning (AutoML) for well-researched areas, its application to tasks beyond computer vision is still under-explored. As less-studied domains are precisely those where we expect AutoML to have the greatest impact, in this work we study NAS for efficiently solving diverse problems. Seeking an approach that is fast, simple, and broadly applicable, we fix a standard convolutional network (CNN) topology and propose to search for the right kernel sizes and dilations its operations should take on. This dramatically expands the model's capacity to extract features at multiple resolutions for different types of data while only requiring search over the operation space. To overcome the efficiency challenges of naive weight-sharing in this search space, we introduce DASH, a differentiable NAS algorithm that computes the mixture-of-operations using the Fourier diagonalization of convolution, achieving both a better asymptotic complexity and an up-to-10x search time speedup in practice. We evaluate DASH on NAS-Bench-360, a suite of ten tasks designed for benchmarking NAS in diverse domains. DASH outperforms state-of-the-art methods in aggregate, attaining the best-known automated performance on seven tasks. Meanwhile, on six of the ten tasks, the combined search and retraining time is less than 2x slower than simply training a CNN backbone that is far less accurate.

Compressing deep neural networks while maintaining accuracy is important when we want to deploy large, powerful models in production and/or edge devices. One common technique used to achieve this goal is knowledge distillation. Typically, the output of a static pre-defined teacher (a large base network) is used as soft labels to train and transfer information to a student (or smaller) network. In this paper, we introduce Adjoined Networks, or AN, a learning paradigm that trains both the original base network and the smaller compressed network together. In our training approach, the parameters of the smaller network are shared across both the base and the compressed networks. Using our training paradigm, we can simultaneously compress (the student network) and regularize (the teacher network) any architecture. In this paper, we focus on popular CNN-based architectures used for computer vision tasks. We conduct an extensive experimental evaluation of our training paradigm on various large-scale datasets. Using ResNet-50 as the base network, AN achieves 71.8% top-1 accuracy with only 1.8M parameters and 1.6 GFLOPs on the ImageNet data-set. We further propose Differentiable Adjoined Networks (DAN), a training paradigm that augments AN by using neural architecture search to jointly learn both the width and the weights for each layer of the smaller network. DAN achieves ResNet-50 level accuracy on ImageNet with $3.8\times$ fewer parameters and $2.2\times$ fewer FLOPs.

The time and effort involved in hand-designing deep neural networks is immense. This has prompted the development of Neural Architecture Search (NAS) techniques to automate this design. However, NAS algorithms tend to be slow and expensive; they need to train vast numbers of candidate networks to inform the search process. This could be alleviated if we could partially predict a network's trained accuracy from its initial state. In this work, we examine the overlap of activations between datapoints in untrained networks and motivate how this can give a measure which is usefully indicative of a network's trained performance. We incorporate this measure into a simple algorithm that allows us to search for powerful networks without any training in a matter of seconds on a single GPU, and verify its effectiveness on NAS-Bench-101, NAS-Bench-201, NATS-Bench, and Network Design Spaces. Our approach can be readily combined with more expensive search methods; we examine a simple adaptation of regularised evolutionary search. Code for reproducing our experiments is available at //github.com/BayesWatch/nas-without-training.

Graph Neural Networks (GNNs) are information processing architectures for signals supported on graphs. They are presented here as generalizations of convolutional neural networks (CNNs) in which individual layers contain banks of graph convolutional filters instead of banks of classical convolutional filters. Otherwise, GNNs operate as CNNs. Filters are composed with pointwise nonlinearities and stacked in layers. It is shown that GNN architectures exhibit equivariance to permutation and stability to graph deformations. These properties provide a measure of explanation respecting the good performance of GNNs that can be observed empirically. It is also shown that if graphs converge to a limit object, a graphon, GNNs converge to a corresponding limit object, a graphon neural network. This convergence justifies the transferability of GNNs across networks with different number of nodes.

Since hardware resources are limited, the objective of training deep learning models is typically to maximize accuracy subject to the time and memory constraints of training and inference. We study the impact of model size in this setting, focusing on Transformer models for NLP tasks that are limited by compute: self-supervised pretraining and high-resource machine translation. We first show that even though smaller Transformer models execute faster per iteration, wider and deeper models converge in significantly fewer steps. Moreover, this acceleration in convergence typically outpaces the additional computational overhead of using larger models. Therefore, the most compute-efficient training strategy is to counterintuitively train extremely large models but stop after a small number of iterations. This leads to an apparent trade-off between the training efficiency of large Transformer models and the inference efficiency of small Transformer models. However, we show that large models are more robust to compression techniques such as quantization and pruning than small models. Consequently, one can get the best of both worlds: heavily compressed, large models achieve higher accuracy than lightly compressed, small models.

Deep learning has revolutionized many machine learning tasks in recent years, ranging from image classification and video processing to speech recognition and natural language understanding. The data in these tasks are typically represented in the Euclidean space. However, there is an increasing number of applications where data are generated from non-Euclidean domains and are represented as graphs with complex relationships and interdependency between objects. The complexity of graph data has imposed significant challenges on existing machine learning algorithms. Recently, many studies on extending deep learning approaches for graph data have emerged. In this survey, we provide a comprehensive overview of graph neural networks (GNNs) in data mining and machine learning fields. We propose a new taxonomy to divide the state-of-the-art graph neural networks into different categories. With a focus on graph convolutional networks, we review alternative architectures that have recently been developed; these learning paradigms include graph attention networks, graph autoencoders, graph generative networks, and graph spatial-temporal networks. We further discuss the applications of graph neural networks across various domains and summarize the open source codes and benchmarks of the existing algorithms on different learning tasks. Finally, we propose potential research directions in this fast-growing field.

Deep Learning has enabled remarkable progress over the last years on a variety of tasks, such as image recognition, speech recognition, and machine translation. One crucial aspect for this progress are novel neural architectures. Currently employed architectures have mostly been developed manually by human experts, which is a time-consuming and error-prone process. Because of this, there is growing interest in automated neural architecture search methods. We provide an overview of existing work in this field of research and categorize them according to three dimensions: search space, search strategy, and performance estimation strategy.

Many natural language processing tasks solely rely on sparse dependencies between a few tokens in a sentence. Soft attention mechanisms show promising performance in modeling local/global dependencies by soft probabilities between every two tokens, but they are not effective and efficient when applied to long sentences. By contrast, hard attention mechanisms directly select a subset of tokens but are difficult and inefficient to train due to their combinatorial nature. In this paper, we integrate both soft and hard attention into one context fusion model, "reinforced self-attention (ReSA)", for the mutual benefit of each other. In ReSA, a hard attention trims a sequence for a soft self-attention to process, while the soft attention feeds reward signals back to facilitate the training of the hard one. For this purpose, we develop a novel hard attention called "reinforced sequence sampling (RSS)", selecting tokens in parallel and trained via policy gradient. Using two RSS modules, ReSA efficiently extracts the sparse dependencies between each pair of selected tokens. We finally propose an RNN/CNN-free sentence-encoding model, "reinforced self-attention network (ReSAN)", solely based on ReSA. It achieves state-of-the-art performance on both Stanford Natural Language Inference (SNLI) and Sentences Involving Compositional Knowledge (SICK) datasets.

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