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Memory replay may be key to learning in biological brains, which manage to learn new tasks continually without catastrophically interfering with previous knowledge. On the other hand, artificial neural networks suffer from catastrophic forgetting and tend to only perform well on tasks that they were recently trained on. In this work we explore the application of latent space based memory replay for classification using artificial neural networks. We are able to preserve good performance in previous tasks by storing only a small percentage of the original data in a compressed latent space version.

Normalization techniques have become a basic component in modern convolutional neural networks (ConvNets). In particular, many recent works demonstrate that promoting the orthogonality of the weights helps train deep models and improve robustness. For ConvNets, most existing methods are based on penalizing or normalizing weight matrices derived from concatenating or flattening the convolutional kernels. These methods often destroy or ignore the benign convolutional structure of the kernels; therefore, they are often expensive or impractical for deep ConvNets. In contrast, we introduce a simple and efficient "Convolutional Normalization" (ConvNorm) method that can fully exploit the convolutional structure in the Fourier domain and serve as a simple plug-and-play module to be conveniently incorporated into any ConvNets. Our method is inspired by recent work on preconditioning methods for convolutional sparse coding and can effectively promote each layer's channel-wise isometry. Furthermore, we show that our ConvNorm can reduce the layerwise spectral norm of the weight matrices and hence improve the Lipschitzness of the network, leading to easier training and improved robustness for deep ConvNets. Applied to classification under noise corruptions and generative adversarial network (GAN), we show that the ConvNorm improves the robustness of common ConvNets such as ResNet and the performance of GAN. We verify our findings via numerical experiments on CIFAR and ImageNet.

Potential Drug-Drug Interaction(DDI) occurring while treating complex or co-existing diseases with drug combinations may cause changes in drugs' pharmacological activity. Therefore, DDI prediction has been an important task in the medical healthy machine learning community. Graph-based learning methods have recently aroused widespread interest and are proved to be a priority for this task. However, these methods are often limited to exploiting the inter-view drug molecular structure and ignoring the drug's intra-view interaction relationship, vital to capturing the complex DDI patterns. This study presents a new method, multi-view graph contrastive representation learning for drug-drug interaction prediction, MIRACLE for brevity, to capture inter-view molecule structure and intra-view interactions between molecules simultaneously. MIRACLE treats a DDI network as a multi-view graph where each node in the interaction graph itself is a drug molecular graph instance. We use GCN to encode DDI relationships and a bond-aware attentive message propagating method to capture drug molecular structure information in the MIRACLE learning stage. Also, we propose a novel unsupervised contrastive learning component to balance and integrate the multi-view information. Comprehensive experiments on multiple real datasets show that MIRACLE outperforms the state-of-the-art DDI prediction models consistently.

Graph Convolutional Networks (GCNs) have been widely used due to their outstanding performance in processing graph-structured data. However, the undirected graphs limit their application scope. In this paper, we extend spectral-based graph convolution to directed graphs by using first- and second-order proximity, which can not only retain the connection properties of the directed graph, but also expand the receptive field of the convolution operation. A new GCN model, called DGCN, is then designed to learn representations on the directed graph, leveraging both the first- and second-order proximity information. We empirically show the fact that GCNs working only with DGCNs can encode more useful information from graph and help achieve better performance when generalized to other models. Moreover, extensive experiments on citation networks and co-purchase datasets demonstrate the superiority of our model against the state-of-the-art methods.

When we humans look at a video of human-object interaction, we can not only infer what is happening but we can even extract actionable information and imitate those interactions. On the other hand, current recognition or geometric approaches lack the physicality of action representation. In this paper, we take a step towards a more physical understanding of actions. We address the problem of inferring contact points and the physical forces from videos of humans interacting with objects. One of the main challenges in tackling this problem is obtaining ground-truth labels for forces. We sidestep this problem by instead using a physics simulator for supervision. Specifically, we use a simulator to predict effects and enforce that estimated forces must lead to the same effect as depicted in the video. Our quantitative and qualitative results show that (a) we can predict meaningful forces from videos whose effects lead to accurate imitation of the motions observed, (b) by jointly optimizing for contact point and force prediction, we can improve the performance on both tasks in comparison to independent training, and (c) we can learn a representation from this model that generalizes to novel objects using few shot examples.

Graph autoencoders (AE) and variational autoencoders (VAE) recently emerged as powerful node embedding methods. In particular, graph AE and VAE were successfully leveraged to tackle the challenging link prediction problem, aiming at figuring out whether some pairs of nodes from a graph are connected by unobserved edges. However, these models focus on undirected graphs and therefore ignore the potential direction of the link, which is limiting for numerous real-life applications. In this paper, we extend the graph AE and VAE frameworks to address link prediction in directed graphs. We present a new gravity-inspired decoder scheme that can effectively reconstruct directed graphs from a node embedding. We empirically evaluate our method on three different directed link prediction tasks, for which standard graph AE and VAE perform poorly. We achieve competitive results on three real-world graphs, outperforming several popular baselines.

While supervised learning has enabled great progress in many applications, unsupervised learning has not seen such widespread adoption, and remains an important and challenging endeavor for artificial intelligence. In this work, we propose a universal unsupervised learning approach to extract useful representations from high-dimensional data, which we call Contrastive Predictive Coding. The key insight of our model is to learn such representations by predicting the future in latent space by using powerful autoregressive models. We use a probabilistic contrastive loss which induces the latent space to capture information that is maximally useful to predict future samples. It also makes the model tractable by using negative sampling. While most prior work has focused on evaluating representations for a particular modality, we demonstrate that our approach is able to learn useful representations achieving strong performance on four distinct domains: speech, images, text and reinforcement learning in 3D environments.

Deep neural networks are susceptible to adversarial attacks. In computer vision, well-crafted perturbations to images can cause neural networks to make mistakes such as identifying a panda as a gibbon or confusing a cat with a computer. Previous adversarial examples have been designed to degrade performance of models or cause machine learning models to produce specific outputs chosen ahead of time by the attacker. We introduce adversarial attacks that instead reprogram the target model to perform a task chosen by the attacker---without the attacker needing to specify or compute the desired output for each test-time input. This attack is accomplished by optimizing for a single adversarial perturbation, of unrestricted magnitude, that can be added to all test-time inputs to a machine learning model in order to cause the model to perform a task chosen by the adversary when processing these inputs---even if the model was not trained to do this task. These perturbations can be thus considered a program for the new task. We demonstrate adversarial reprogramming on six ImageNet classification models, repurposing these models to perform a counting task, as well as two classification tasks: classification of MNIST and CIFAR-10 examples presented within the input to the ImageNet model.

Inspired by predictive coding in neuroscience, we designed a bi-directional and recurrent neural net, namely deep predictive coding networks (PCN). It uses convolutional layers in both feedforward and feedback networks, and recurrent connections within each layer. Feedback connections from a higher layer carry the prediction of its lower-layer representation; feedforward connections carry the prediction errors to its higher-layer. Given image input, PCN runs recursive cycles of bottom-up and top-down computation to update its internal representations to reduce the difference between bottom-up input and top-down prediction at every layer. After multiple cycles of recursive updating, the representation is used for image classification. In training, the classification error backpropagates across layers and in time. With benchmark data (CIFAR-10/100, SVHN, and MNIST), PCN was found to always outperform its feedforward-only counterpart: a model without any mechanism for recurrent dynamics, and its performance tended to improve given more cycles of computation over time. In short, PCN reuses a single architecture to recursively run bottom-up and top-down process, enabling an increasingly longer cascade of non-linear transformation. For image classification, PCN refines its representation over time towards more accurate and definitive recognition.

We present two deep generative models based on Variational Autoencoders to improve the accuracy of drug response prediction. Our models, Perturbation Variational Autoencoder and its semi-supervised extension, Drug Response Variational Autoencoder (Dr.VAE), learn latent representation of the underlying gene states before and after drug application that depend on: (i) drug-induced biological change of each gene and (ii) overall treatment response outcome. Our VAE-based models outperform the current published benchmarks in the field by anywhere from 3 to 11% AUROC and 2 to 30% AUPR. In addition, we found that better reconstruction accuracy does not necessarily lead to improvement in classification accuracy and that jointly trained models perform better than models that minimize reconstruction error independently.