揭示t-SNE能量景观中大量临界点的成因及其对数据结构的误导性影响

This paper considers the energy landscape of the t-SNE algorithm. While this algorithm has enjoyed broad adoption, the non-convexity of the associated energy has made it difficult to rigorously understand what the algorithm captures in many settings. In particular, a number of well-known numerical examples, several of which are reproduced in this article, suggest a complicated energy landscape with many local minimizers that do not respect the topology or clustering structure of the underlying data. This work seeks to provide first steps towards a rigorous explanation of these phenomena. Specifically, for a general family of energies, which include both the original t-SNE algorithm and recently identified large data limits, and for densities in feature space which obey a continuous symmetry, we construct infinite families of distinct critical points. These critical points are based upon identifying pairs of discrete symmetries, one in the original feature space and the other in the target embedding space, which are preserved under gradient dynamics. These critical configurations exhibit many characteristics, such as topology breaking and spurious clustering, which are often observed empirically. Finally, numerical and analytical examples are given throughout as a means of illustrating the approach.