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Table 2 Mean scores and proportion of unique solutions for QED and the normalised version of the SAscore

From: EvoMol: a flexible and interpretable evolutionary algorithm for unbiased de novo molecular generation

Method QED SAscore
Mean Unique % Mean Unique %
ORGAN [6] 0.52 69.4 0.83 45.9
MOLGAN [18] 0.62 2.2 0.95 2.1
EvoMol 0.948 100.0 0.95 100.0
  1. The values for state-of-the-art methods are reported from [18]. Results for EvoMol are the average of the mean score over 10 executions