Similarity Coefficients for Binary Chemoinformatics Data: Overview and Extended Comparison Using Simulated and Real Data Sets

  • Roberto Todeschini
    Milano Chemometrics and QSAR Research Group, Department of Environmental Sciences, University of Milano-Bicocca, Piazza della Scienza 1, 20126, Milano, Italy
  • Viviana Consonni
    Milano Chemometrics and QSAR Research Group, Department of Environmental Sciences, University of Milano-Bicocca, Piazza della Scienza 1, 20126, Milano, Italy
  • Hua Xiang
    Information School, University of Sheffield, Sheffield S1 4DP, United Kingdom
  • John Holliday
    Information School, University of Sheffield, Sheffield S1 4DP, United Kingdom
  • Massimo Buscema
    SEMEION, via Sersale 117,00128, Roma, Italy
  • Peter Willett
    Information School, University of Sheffield, Sheffield S1 4DP, United Kingdom

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