Heavy-tailed kernels reveal a finer cluster structure in t-SNE visualisations

Mach Learn Knowl Discov Databases. 2020:11906:124-139. doi: 10.1007/978-3-030-46150-8_8. Epub 2020 Apr 30.

Abstract

T-distributed stochastic neighbour embedding (t-SNE) is a widely used data visualisation technique. It differs from its predecessor SNE by the low-dimensional similarity kernel: the Gaussian kernel was replaced by the heavy-tailed Cauchy kernel, solving the 'crowding problem' of SNE. Here, we develop an efficient implementation of t-SNE for a t-distribution kernel with an arbitrary degree of freedom ν, with ν → ∞ corresponding to SNE and ν = 1 corresponding to the standard t-SNE. Using theoretical analysis and toy examples, we show that ν < 1 can further reduce the crowding problem and reveal finer cluster structure that is invisible in standard t-SNE. We further demonstrate the striking effect of heavier-tailed kernels on large real-life data sets such as MNIST, single-cell RNA-sequencing data, and the HathiTrust library. We use domain knowledge to confirm that the revealed clusters are meaningful. Overall, we argue that modifying the tail heaviness of the t-SNE kernel can yield additional insight into the cluster structure of the data.

Keywords: data visualisation; dimensionality reduction; t-SNE.