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Finite linear least squares is one of the core problems of numerical linear algebra, with countless applications across science and engineering. Consequently, there is a rich and ongoing literature on algorithms for solving linear least squares problems. In this paper, we explore a variant in which the system's matrix has one infinite dimension (i.e., it is a quasimatrix). We call such problems semi-infinite linear regression problems. As we show, the semi-infinite case arises in several applications, such as supervised learning and function approximation, and allows for novel interpretations of existing algorithms. We explore semi-infinite linear regression rigorously and algorithmically. To that end, we give a formal framework for working with quasimatrices, and generalize several algorithms designed for the finite problem to the infinite case. Finally, we suggest the use of various sampling methods for obtaining an approximate solution.

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Coreset (or core-set) is a small weighted \emph{subset} $Q$ of an input set $P$ with respect to a given \emph{monotonic} function $f:\mathbb{R}\to\mathbb{R}$ that \emph{provably} approximates its fitting loss $\sum_{p\in P}f(p\cdot x)$ to \emph{any} given $x\in\mathbb{R}^d$. Using $Q$ we can obtain approximation of $x^*$ that minimizes this loss, by running \emph{existing} optimization algorithms on $Q$. In this work we provide: (i) A lower bound which proves that there are sets with no coresets smaller than $n=|P|$ for general monotonic loss functions. (ii) A proof that, under a natural assumption that holds e.g. for logistic regression and the sigmoid activation functions, a small coreset exists for \emph{any} input $P$. (iii) A generic coreset construction algorithm that computes such a small coreset $Q$ in $O(nd+n\log n)$ time, and (iv) Experimental results which demonstrate that our coresets are effective and are much smaller in practice than predicted in theory.

Motivated by the Novikov equation and its peakon problem, we propose a new mixed type Hermite--Pad\'{e} approximation whose unique solution is a sequence of polynomials constructed with the help of Pfaffians. These polynomials belong to the family of recently proposed partial-skew-orthogonal polynomials. The relevance of partial-skew-orthogonal polynomials is especially visible in the approximation problem germane to the Novikov peakon problem so that we obtain explicit inverse formulae in terms of Pfaffians by reformulating the inverse spectral problem for the Novikov multipeakons. Furthermore, we investigate two Hermite--Pad\'{e} approximations for the related spectral problem of the discrete dual cubic string, and show that these approximation problems can also be solved in terms of partial-skew-orthogonal polynomials and nonsymmetric Cauchy biorthogonal polynomials. This formulation results in a new correspondence among several integrable lattices.

When the sizes of the state and action spaces are large, solving MDPs can be computationally prohibitive even if the probability transition matrix is known. So in practice, a number of techniques are used to approximately solve the dynamic programming problem, including lookahead, approximate policy evaluation using an m-step return, and function approximation. In a recent paper, (Efroni et al. 2019) studied the impact of lookahead on the convergence rate of approximate dynamic programming. In this paper, we show that these convergence results change dramatically when function approximation is used in conjunction with lookout and approximate policy evaluation using an m-step return. Specifically, we show that when linear function approximation is used to represent the value function, a certain minimum amount of lookahead and multi-step return is needed for the algorithm to even converge. And when this condition is met, we characterize the performance of policies obtained using such approximate policy iteration. Our results are presented for two different procedures to compute the function approximation: linear least-squares regression and gradient descent.

We consider the problem of efficiently solving large-scale linear least squares problems that have one or more linear constraints that must be satisfied exactly. Whilst some classical approaches are theoretically well founded, they can face difficulties when the matrix of constraints contains dense rows or if an algorithmic transformation used in the solution process results in a modified problem that is much denser than the original one. To address this, we propose modifications and new ideas, with an emphasis on requiring the constraints are satisfied with a small residual. We examine combining the null-space method with our recently developed algorithm for computing a null space basis matrix for a "wide" matrix. We further show that a direct elimination approach enhanced by careful pivoting can be effective in transforming the problem to an unconstrained sparse-dense least squares problem that can be solved with existing direct or iterative methods. We also present a number of solution variants that employ an augmented system formulation, which can be attractive when solving a sequence of related problems. Numerical experiments using problems coming from practical applications are used throughout to demonstrate the effectiveness of the different approaches.

We establish a new perturbation theory for orthogonal polynomials using a Riemann-Hilbert approach and consider applications in numerical linear algebra and random matrix theory. We show that the orthogonal polynomials with respect to two measures can be effectively compared using the difference of their Stieltjes transforms on a suitably chosen contour. Moreover, when two measures are close and satisfy some regularity conditions, we use the theta functions of a hyperelliptic Riemann surface to derive explicit and accurate expansion formulae for the perturbed orthogonal polynomials. The leading error terms can be fully characterized by the difference of the Stieltjes transforms on the contour. The results are applied to analyze several numerical algorithms from linear algebra, including the Lanczos tridiagonalization procedure, the Cholesky factorization and the conjugate gradient algorithm (CGA). As a case study, we investigate these algorithms applied to a general spiked sample covariance matrix model by considering the eigenvector empirical spectral distribution and its limit, allowing for precise estimates on the algorithms as the number of iterations diverges. For this concrete random matrix model, beyond the first order expansion, we derive a mesoscopic central limit theorem for the associated orthogonal polynomials and other quantities relevant to numerical algorithms.

Data augmentation has been widely used to improve generalizability of machine learning models. However, comparatively little work studies data augmentation for graphs. This is largely due to the complex, non-Euclidean structure of graphs, which limits possible manipulation operations. Augmentation operations commonly used in vision and language have no analogs for graphs. Our work studies graph data augmentation for graph neural networks (GNNs) in the context of improving semi-supervised node-classification. We discuss practical and theoretical motivations, considerations and strategies for graph data augmentation. Our work shows that neural edge predictors can effectively encode class-homophilic structure to promote intra-class edges and demote inter-class edges in given graph structure, and our main contribution introduces the GAug graph data augmentation framework, which leverages these insights to improve performance in GNN-based node classification via edge prediction. Extensive experiments on multiple benchmarks show that augmentation via GAug improves performance across GNN architectures and datasets.

The graph convolution network (GCN) is a widely-used facility to realize graph-based semi-supervised learning, which usually integrates node features and graph topologic information to build learning models. However, as for multi-label learning tasks, the supervision part of GCN simply minimizes the cross-entropy loss between the last layer outputs and the ground-truth label distribution, which tends to lose some useful information such as label correlations, so that prevents from obtaining high performance. In this paper, we pro-pose a novel GCN-based semi-supervised learning approach for multi-label classification, namely ML-GCN. ML-GCN first uses a GCN to embed the node features and graph topologic information. Then, it randomly generates a label matrix, where each row (i.e., label vector) represents a kind of labels. The dimension of the label vector is the same as that of the node vector before the last convolution operation of GCN. That is, all labels and nodes are embedded in a uniform vector space. Finally, during the ML-GCN model training, label vectors and node vectors are concatenated to serve as the inputs of the relaxed skip-gram model to detect the node-label correlation as well as the label-label correlation. Experimental results on several graph classification datasets show that the proposed ML-GCN outperforms four state-of-the-art methods.

Intersection over Union (IoU) is the most popular evaluation metric used in the object detection benchmarks. However, there is a gap between optimizing the commonly used distance losses for regressing the parameters of a bounding box and maximizing this metric value. The optimal objective for a metric is the metric itself. In the case of axis-aligned 2D bounding boxes, it can be shown that $IoU$ can be directly used as a regression loss. However, $IoU$ has a plateau making it infeasible to optimize in the case of non-overlapping bounding boxes. In this paper, we address the weaknesses of $IoU$ by introducing a generalized version as both a new loss and a new metric. By incorporating this generalized $IoU$ ($GIoU$) as a loss into the state-of-the art object detection frameworks, we show a consistent improvement on their performance using both the standard, $IoU$ based, and new, $GIoU$ based, performance measures on popular object detection benchmarks such as PASCAL VOC and MS COCO.

Recent years have witnessed the enormous success of low-dimensional vector space representations of knowledge graphs to predict missing facts or find erroneous ones. Currently, however, it is not yet well-understood how ontological knowledge, e.g. given as a set of (existential) rules, can be embedded in a principled way. To address this shortcoming, in this paper we introduce a framework based on convex regions, which can faithfully incorporate ontological knowledge into the vector space embedding. Our technical contribution is two-fold. First, we show that some of the most popular existing embedding approaches are not capable of modelling even very simple types of rules. Second, we show that our framework can represent ontologies that are expressed using so-called quasi-chained existential rules in an exact way, such that any set of facts which is induced using that vector space embedding is logically consistent and deductively closed with respect to the input ontology.

In this paper we discuss policy iteration methods for approximate solution of a finite-state discounted Markov decision problem, with a focus on feature-based aggregation methods and their connection with deep reinforcement learning schemes. We introduce features of the states of the original problem, and we formulate a smaller "aggregate" Markov decision problem, whose states relate to the features. The optimal cost function of the aggregate problem, a nonlinear function of the features, serves as an architecture for approximation in value space of the optimal cost function or the cost functions of policies of the original problem. We discuss properties and possible implementations of this type of aggregation, including a new approach to approximate policy iteration. In this approach the policy improvement operation combines feature-based aggregation with reinforcement learning based on deep neural networks, which is used to obtain the needed features. We argue that the cost function of a policy may be approximated much more accurately by the nonlinear function of the features provided by aggregation, than by the linear function of the features provided by deep reinforcement learning, thereby potentially leading to more effective policy improvement.

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