Low-dimensional embeddings and visualizations are an indispensable tool for analysis of high-dimensional data. State-of-the-art methods, such as tSNE and UMAP, excel in unveiling local structures hidden in high-dimensional data and are therefore routinely applied in standard analysis pipelines in biology. We show, however, that these methods fail to reconstruct local properties, such as relative differences in densities (Fig. 1) and that apparent differences in cluster size can arise from computational artifact caused by differing sample sizes (Fig. 2). Providing a theoretical analysis of this issue, we then suggest dtSNE, which approximately conserves local densities. In an extensive study on synthetic benchmark and real world data comparing against five state-of-the-art methods, we empirically show that dtSNE provides similar global reconstruction, but yields much more accurate depictions of local distances and relative densities.
翻译:低维嵌入和可视化是分析高维数据的一个不可或缺的工具。tSNE和UMAP等最先进的方法在揭开高维数据中隐藏的地方结构方面非常出色,因此在生物学的标准分析管道中经常应用。然而,我们表明,这些方法未能重建地方特性,例如密度的相对差异(图1),以及由于不同样本大小造成的计算工艺品群大小的明显差异(图2)。我们从理论上分析这一问题,然后建议dtSNE, 大约保存当地密度。在对合成基准和实际世界数据进行的广泛研究中,我们从经验上表明,dtSNE提供了类似的全球重建,但是对当地距离和相对密度的描述要准确得多。