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Selecting High-Dimensional Representations of Physical Systems by Reweighted Diffusion Maps

[Image: see text] Constructing reduced representations of high-dimensional systems is a fundamental problem in physical chemistry. Many unsupervised machine learning methods can automatically find such low-dimensional representations. However, an often overlooked problem is what high-dimensional rep...

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Detalles Bibliográficos
Autor principal: Rydzewski, Jakub
Formato: Online Artículo Texto
Lenguaje:English
Publicado: American Chemical Society 2023
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10041639/
https://www.ncbi.nlm.nih.gov/pubmed/36897996
http://dx.doi.org/10.1021/acs.jpclett.3c00265