rxn.metrics.classification_translation.maybe_classify_predictions

rxn.metrics.classification_translation.maybe_classify_predictions(classification_model, retro_files, batch_size, gpu)[source]

Classify the reactions for determining the diversity metric.

Only executed if a classification model is available.

Parameters
  • classification_model (Optional[Path]) –

  • retro_files (RetroFiles) –

  • batch_size (int) –

  • gpu (bool) –

Return type

None