Linear Time Feature Selection for Regularized Least-Squares

We propose a novel algorithm for greedy forward feature selection for regularized least-squares (RLS) regression and classification, also known as the least-squares support vector machine or ridge regression. The algorithm, which we call greedy RLS, starts from the empty feature set, and on each iteration adds the feature whose addition provides the best leave-one-out cross-validation performance. Our method is considerably faster than the previously proposed ones, since its time complexity is linear in the number of training examples, the number of features in the original data set, and the desired size of the set of selected features. Therefore, as a side effect we obtain a new training algorithm for learning sparse linear RLS predictors which can be used for large scale learning. This speed is possible due to matrix calculus based short-cuts for leave-one-out and feature addition. We experimentally demonstrate the scalability of our algorithm and its ability to find good quality feature sets.Comment: 17 pages, 15 figure

Speeding up neighborhood search in local Gaussian process prediction

Recent implementations of local approximate Gaussian process models have pushed computational boundaries for non-linear, non-parametric prediction problems, particularly when deployed as emulators for computer experiments. Their flavor of spatially independent computation accommodates massive parallelization, meaning that they can handle designs two or more orders of magnitude larger than previously. However, accomplishing that feat can still require massive supercomputing resources. Here we aim to ease that burden. We study how predictive variance is reduced as local designs are built up for prediction. We then observe how the exhaustive and discrete nature of an important search subroutine involved in building such local designs may be overly conservative. Rather, we suggest that searching the space radially, i.e., continuously along rays emanating from the predictive location of interest, is a far thriftier alternative. Our empirical work demonstrates that ray-based search yields predictors with accuracy comparable to exhaustive search, but in a fraction of the time - bringing a supercomputer implementation back onto the desktop.Comment: 24 pages, 5 figures, 4 table

Fast Conical Hull Algorithms for Near-separable Non-negative Matrix Factorization

The separability assumption (Donoho & Stodden, 2003; Arora et al., 2012) turns non-negative matrix factorization (NMF) into a tractable problem. Recently, a new class of provably-correct NMF algorithms have emerged under this assumption. In this paper, we reformulate the separable NMF problem as that of finding the extreme rays of the conical hull of a finite set of vectors. From this geometric perspective, we derive new separable NMF algorithms that are highly scalable and empirically noise robust, and have several other favorable properties in relation to existing methods. A parallel implementation of our algorithm demonstrates high scalability on shared- and distributed-memory machines.Comment: 15 pages, 6 figure