Sparse Cholesky factorization by Kullback-Leibler minimization
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Nontrigonometric harmonic analysis involving wavelets and other special systems (42C40) Martingales with discrete parameter (60G42) Computational methods for sparse matrices (65F50) Multigrid methods; domain decomposition for boundary value problems involving PDEs (65N55) Probabilistic methods, particle methods, etc. for boundary value problems involving PDEs (65N75) Analysis of algorithms (68W40)
Abstract: We propose to compute a sparse approximate inverse Cholesky factor of a dense covariance matrix by minimizing the Kullback-Leibler divergence between the Gaussian distributions and , subject to a sparsity constraint. Surprisingly, this problem has a closed-form solution that can be computed efficiently, recovering the popular Vecchia approximation in spatial statistics. Based on recent results on the approximate sparsity of inverse Cholesky factors of obtained from pairwise evaluation of Green's functions of elliptic boundary-value problems at points , we propose an elimination ordering and sparsity pattern that allows us to compute -approximate inverse Cholesky factors of such in computational complexity in space and in time. To the best of our knowledge, this is the best asymptotic complexity for this class of problems. Furthermore, our method is embarrassingly parallel, automatically exploits low-dimensional structure in the data, and can perform Gaussian-process regression in linear (in ) space complexity. Motivated by the optimality properties of our methods, we propose methods for applying it to the joint covariance of training and prediction points in Gaussian-process regression, greatly improving stability and computational cost. Finally, we show how to apply our method to the important setting of Gaussian processes with additive noise, sacrificing neither accuracy nor computational complexity.
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