Physically interpretable performance metrics for clustering

Clustering is a type of machine learning technique, which is used to group huge amounts of data based on their similarity into separate groups or clusters. Clustering is a very important task that is nowadays used to analyze the huge and diverse amount of data coming out of molecular dynamics (MD) s...

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Veröffentlicht in:The Journal of chemical physics 2024-12, Vol.161 (24)
Hauptverfasser: Mondal, Kinjal, Klauda, Jeffery B.
Format: Artikel
Sprache:eng
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