Goto

Collaborating Authors

 Urry, Matthew


Kernels and learning curves for Gaussian process regression on random graphs

Neural Information Processing Systems

We investigate how well Gaussian process regression can learn functions defined on graphs, using large regular random graphs as a paradigmatic example. Random-walk based kernels are shown to have some surprising properties: within the standard approximation of a locally tree-like graph structure, the kernel does not become constant, i.e.neighbouring function values do not become fully correlated, when the lengthscale $\sigma$ of the kernel is made large. Instead the kernel attains a non-trivial limiting form, which we calculate. The fully correlated limit is reached only once loops become relevant, and we estimate where the crossover to this regime occurs. Our main subject are learning curves of Bayes error versus training set size.


Random walk kernels and learning curves for Gaussian process regression on random graphs

arXiv.org Machine Learning

We consider learning on graphs, guided by kernels that encode similarity between vertices. Our focus is on random walk kernels, the analogues of squared exponential kernels in Euclidean spaces. We show that on large, locally treelike, graphs these have some counter-intuitive properties, specifically in the limit of large kernel lengthscales. We consider using these kernels as covariance matrices of e.g.\ Gaussian processes (GPs). In this situation one typically scales the prior globally to normalise the average of the prior variance across vertices. We demonstrate that, in contrast to the Euclidean case, this generically leads to significant variation in the prior variance across vertices, which is undesirable from the probabilistic modelling point of view. We suggest the random walk kernel should be normalised locally, so that each vertex has the same prior variance, and analyse the consequences of this by studying learning curves for Gaussian process regression. Numerical calculations as well as novel theoretical predictions for the learning curves using belief propagation make it clear that one obtains distinctly different probabilistic models depending on the choice of normalisation. Our method for predicting the learning curves using belief propagation is significantly more accurate than previous approximations and should become exact in the limit of large random graphs.


Exact learning curves for Gaussian process regression on large random graphs

Neural Information Processing Systems

We study learning curves for Gaussian process regression which characterise performance interms of the Bayes error averaged over datasets of a given size. Whilst learning curves are in general very difficult to calculate we show that for discrete input domains, where similarity between input points is characterised in terms of a graph, accurate predictions can be obtained. These should in fact become exact for large graphs drawn from a broad range of random graph ensembles with arbitrary degree distributions where each input (node) is connected only to a finite number of others. Our approach is based on translating the appropriate belief propagation equations to the graph ensemble. We demonstrate the accuracy of the predictions for Poisson (Erdos-Renyi) and regular random graphs, and discuss when and why previous approximations of the learning curve fail.


Kernels and learning curves for Gaussian process regression on random graphs

Neural Information Processing Systems

We investigate how well Gaussian process regression can learn functions defined on graphs, using large regular random graphs as a paradigmatic example. Random-walk based kernels are shown to have some surprising properties: within the standard approximation of a locally tree-like graph structure, the kernel does not become constant, i.e.neighbouring function values do not become fully correlated, when the lengthscale $\sigma$ of the kernel is made large. Instead the kernel attains a non-trivial limiting form, which we calculate. The fully correlated limit is reached only once loops become relevant, and we estimate where the crossover to this regime occurs. Our main subject are learning curves of Bayes error versus training set size. We show that these are qualitatively well predicted by a simple approximation using only the spectrum of a large tree as input, and generically scale with $n/V$, the number of training examples per vertex. We also explore how this behaviour changes once kernel lengthscales are large enough for loops to become important.