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We investigate the sample complexity of bounded two-layer neural networks using different activation functions. In particular, we consider the class $$ \mathcal{H} = \left\{\textbf{x}\mapsto \langle \textbf{v}, \sigma \circ W\textbf{b} + \textbf{b} \rangle : \textbf{b}\in\mathbb{R}^d, W \in \mathbb{R}^{\mathcal{T}\times d}, \textbf{v} \in \mathbb{R}^{\mathcal{T}}\right\} $$ where the spectral norm of $W$ and $\textbf{v}$ is bounded by $O(1)$, the Frobenius norm of $W$ is bounded from its initialization by $R > 0$, and $\sigma$ is a Lipschitz activation function. We prove that if $\sigma$ is element-wise, then the sample complexity of $\mathcal{H}$ has only logarithmic dependency in width and that this complexity is tight, up to logarithmic factors. We further show that the element-wise property of $\sigma$ is essential for a logarithmic dependency bound in width, in the sense that there exist non-element-wise activation functions whose sample complexity is linear in width, for widths that can be up to exponential in the input dimension. For the upper bound, we use the recent approach for norm-based bounds named Approximate Description Length (ADL) by arXiv:1910.05697. We further develop new techniques and tools for this approach that will hopefully inspire future works.

Model selection is a ubiquitous problem that arises in the application of many statistical and machine learning methods. In the likelihood and related settings, it is typical to use the method of information criteria (IC) to choose the most parsimonious among competing models by penalizing the likelihood-based objective function. Theorems guaranteeing the consistency of IC can often be difficult to verify and are often specific and bespoke. We present a set of results that guarantee consistency for a class of IC, which we call PanIC (from the Greek root 'pan', meaning 'of everything'), with easily verifiable regularity conditions. The PanIC are applicable in any loss-based learning problem and are not exclusive to likelihood problems. We illustrate the verification of regularity conditions for model selection problems regarding finite mixture models, least absolute deviation and support vector regression, and principal component analysis, and we demonstrate the effectiveness of the PanIC for such problems via numerical simulations. Furthermore, we present new sufficient conditions for the consistency of BIC-like estimators and provide comparisons of the BIC to PanIC.

Recent advancements have been made in the development of cell-based in-vitro neuronal networks, or organoids. In order to better understand the network structure of these organoids, [6] propose a method for inferring effective connectivity networks from multi-electrode array data. In this paper, a novel statistical method called spectral mirror estimation [2] is applied to a time series of inferred effective connectivity organoid networks. This method produces a one-dimensional iso-mirror representation of the dynamics of the time series of the networks. A classical change point algorithm is then applied to this representation, which successfully detects a neuroscientifically significant change point coinciding with the time inhibitory neurons start appearing and the percentage of astrocytes increases dramatically [9]. This finding demonstrates the potential utility of applying the iso-mirror dynamic structure discovery method to inferred effective connectivity time series of organoid networks.

Interior-point methods offer a highly versatile framework for convex optimization that is effective in theory and practice. A key notion in their theory is that of a self-concordant barrier. We give a suitable generalization of self-concordance to Riemannian manifolds and show that it gives the same structural results and guarantees as in the Euclidean setting, in particular local quadratic convergence of Newton's method. We then analyze a short-step path-following method for optimizing compatible objectives over a convex domain for which one has a self-concordant barrier, and obtain the standard complexity guarantees as in the Euclidean setting. We show that on the positive-definite matrices and other symmetric spaces, the squared distance to a point is a self-concordant function. Our work is motivated by recent progress on scaling problems and non-commutative optimization, and we show that these fit into our framework, yielding algorithms with state-of-the-art complexity guarantees. Furthermore, we show how to apply our methods to computing geometric medians on spaces with constant negative curvature.

We analyse the power of graph neural networks (GNNs) in terms of Boolean circuit complexity and descriptive complexity. We prove that the graph queries that can be computed by a polynomial-size bounded-depth family of GNNs are exactly those definable in the guarded fragment GFO+C of first-order logic with counting and with built-in relations. This puts GNNs in the circuit complexity class TC^0. Remarkably, the GNN families may use arbitrary real weights and a wide class of activation functions that includes the standard ReLU, logistic "sigmoid", and hyperbolic tangent functions. If the GNNs are allowed to use random initialisation and global readout (both standard features of GNNs widely used in practice), they can compute exactly the same queries as bounded depth Boolean circuits with threshold gates, that is, exactly the queries in TC^0. Moreover, we show that queries computable by a single GNN with piecewise linear activations and rational weights are definable in GFO+C without built-in relations. Therefore, they are contained in uniform TC^0.

Graph Neural Networks (GNNs) have been successfully used in many problems involving graph-structured data, achieving state-of-the-art performance. GNNs typically employ a message-passing scheme, in which every node aggregates information from its neighbors using a permutation-invariant aggregation function. Standard well-examined choices such as the mean or sum aggregation functions have limited capabilities, as they are not able to capture interactions among neighbors. In this work, we formalize these interactions using an information-theoretic framework that notably includes synergistic information. Driven by this definition, we introduce the Graph Ordering Attention (GOAT) layer, a novel GNN component that captures interactions between nodes in a neighborhood. This is achieved by learning local node orderings via an attention mechanism and processing the ordered representations using a recurrent neural network aggregator. This design allows us to make use of a permutation-sensitive aggregator while maintaining the permutation-equivariance of the proposed GOAT layer. The GOAT model demonstrates its increased performance in modeling graph metrics that capture complex information, such as the betweenness centrality and the effective size of a node. In practical use-cases, its superior modeling capability is confirmed through its success in several real-world node classification benchmarks.

Learning on big data brings success for artificial intelligence (AI), but the annotation and training costs are expensive. In future, learning on small data is one of the ultimate purposes of AI, which requires machines to recognize objectives and scenarios relying on small data as humans. A series of machine learning models is going on this way such as active learning, few-shot learning, deep clustering. However, there are few theoretical guarantees for their generalization performance. Moreover, most of their settings are passive, that is, the label distribution is explicitly controlled by one specified sampling scenario. This survey follows the agnostic active sampling under a PAC (Probably Approximately Correct) framework to analyze the generalization error and label complexity of learning on small data using a supervised and unsupervised fashion. With these theoretical analyses, we categorize the small data learning models from two geometric perspectives: the Euclidean and non-Euclidean (hyperbolic) mean representation, where their optimization solutions are also presented and discussed. Later, some potential learning scenarios that may benefit from small data learning are then summarized, and their potential learning scenarios are also analyzed. Finally, some challenging applications such as computer vision, natural language processing that may benefit from learning on small data are also surveyed.

Classic machine learning methods are built on the $i.i.d.$ assumption that training and testing data are independent and identically distributed. However, in real scenarios, the $i.i.d.$ assumption can hardly be satisfied, rendering the sharp drop of classic machine learning algorithms' performances under distributional shifts, which indicates the significance of investigating the Out-of-Distribution generalization problem. Out-of-Distribution (OOD) generalization problem addresses the challenging setting where the testing distribution is unknown and different from the training. This paper serves as the first effort to systematically and comprehensively discuss the OOD generalization problem, from the definition, methodology, evaluation to the implications and future directions. Firstly, we provide the formal definition of the OOD generalization problem. Secondly, existing methods are categorized into three parts based on their positions in the whole learning pipeline, namely unsupervised representation learning, supervised model learning and optimization, and typical methods for each category are discussed in detail. We then demonstrate the theoretical connections of different categories, and introduce the commonly used datasets and evaluation metrics. Finally, we summarize the whole literature and raise some future directions for OOD generalization problem. The summary of OOD generalization methods reviewed in this survey can be found at //out-of-distribution-generalization.com.

Deep Learning has revolutionized the fields of computer vision, natural language understanding, speech recognition, information retrieval and more. However, with the progressive improvements in deep learning models, their number of parameters, latency, resources required to train, etc. have all have increased significantly. Consequently, it has become important to pay attention to these footprint metrics of a model as well, not just its quality. We present and motivate the problem of efficiency in deep learning, followed by a thorough survey of the five core areas of model efficiency (spanning modeling techniques, infrastructure, and hardware) and the seminal work there. We also present an experiment-based guide along with code, for practitioners to optimize their model training and deployment. We believe this is the first comprehensive survey in the efficient deep learning space that covers the landscape of model efficiency from modeling techniques to hardware support. Our hope is that this survey would provide the reader with the mental model and the necessary understanding of the field to apply generic efficiency techniques to immediately get significant improvements, and also equip them with ideas for further research and experimentation to achieve additional gains.

Model complexity is a fundamental problem in deep learning. In this paper we conduct a systematic overview of the latest studies on model complexity in deep learning. Model complexity of deep learning can be categorized into expressive capacity and effective model complexity. We review the existing studies on those two categories along four important factors, including model framework, model size, optimization process and data complexity. We also discuss the applications of deep learning model complexity including understanding model generalization capability, model optimization, and model selection and design. We conclude by proposing several interesting future directions.