Relating tSNE and UMAP to Classical Dimensionality Reduction

Fuente: arXiv
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Autores principales: Draganov, Andrew, Dohn, Simon
Formato: Preprint
Publicado: 2023
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author Draganov, Andrew
Dohn, Simon
author_facet Draganov, Andrew
Dohn, Simon
contents It has become standard to use gradient-based dimensionality reduction (DR) methods like tSNE and UMAP when explaining what AI models have learned. This makes sense: these methods are fast, robust, and have an uncanny ability to find semantic patterns in high-dimensional data without supervision. Despite this, gradient-based DR methods lack the most important quality that an explainability method should possess: themselves being explainable. That is, given a UMAP output, it is currently unclear what one can say about the corresponding input. We work towards closing this question by relating UMAP to classical DR techniques. Specifically, we show that one can fully recover methods like PCA, MDS, and ISOMAP in the modern DR paradigm: by applying attractions and repulsions onto a randomly initialized dataset. We also show that, with a small change, Locally Linear Embeddings (LLE) can indistinguishably reproduce UMAP outputs. This implies that the UMAP effective objective is minimized by this modified version of LLE (and vice versa). Given this, we discuss what must be true of UMAP emebddings and present avenues for future work.
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id arxiv_https___arxiv_org_abs_2306_11898
institution arXiv
publishDate 2023
record_format arxiv
spellingShingle Relating tSNE and UMAP to Classical Dimensionality Reduction
Draganov, Andrew
Dohn, Simon
Machine Learning
Artificial Intelligence
It has become standard to use gradient-based dimensionality reduction (DR) methods like tSNE and UMAP when explaining what AI models have learned. This makes sense: these methods are fast, robust, and have an uncanny ability to find semantic patterns in high-dimensional data without supervision. Despite this, gradient-based DR methods lack the most important quality that an explainability method should possess: themselves being explainable. That is, given a UMAP output, it is currently unclear what one can say about the corresponding input. We work towards closing this question by relating UMAP to classical DR techniques. Specifically, we show that one can fully recover methods like PCA, MDS, and ISOMAP in the modern DR paradigm: by applying attractions and repulsions onto a randomly initialized dataset. We also show that, with a small change, Locally Linear Embeddings (LLE) can indistinguishably reproduce UMAP outputs. This implies that the UMAP effective objective is minimized by this modified version of LLE (and vice versa). Given this, we discuss what must be true of UMAP emebddings and present avenues for future work.
title Relating tSNE and UMAP to Classical Dimensionality Reduction
topic Machine Learning
Artificial Intelligence
url https://arxiv.org/abs/2306.11898