Published September 16, 2022 | Version v1
Software Open

Data and software for "Machine Learning Assisted Clustering of Nanoparticles Structures" article

Creators

  • 1. Physics Department, University of Genoa

Description

  • clustering.ipynb - Clustering notebook (K-Means, GMM, Bic, silhouette and gap scores, PCA )
  • program_cna_v01 - program for converting xyz in cna (part I)
  • cna_stats.py - program for converting xyz in cna (part II)
  • 64_cna_data - 64 dimensional data sets
  • histogram data - data for plotting histograms as in the article
  • xyz structures -  files of nanoparticles xyz coordinates

Files

Files (12.3 MB)

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md5:958f49e9b54f35a3ad562b2969790e37
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