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Table 10 Summary of the Decision Forest performance [5] against the NGN performance on ER.

From: Classifying and scoring of molecules with the NGN: new datasets, significance tests, and generalization

Design Method Q(%) SE(%) SP(%) MCC
Leave-10%-Out Decision Forest 81.9 - - -
Leave-20%-Out SMILES-NGN 69.3±2.28 71.7±2.39 66.0±2.74 0.373±0.047
  InChI-NGN 66.1±1.70 69.5±2.65 61.6±1.33 0.309±0.040