Balancing Imbalanced Toxicity Models : Using MolBERT with Focal Loss

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• Finished

  MSCA AIDD /Kaski S.: Advanced machine learning for Innovative Drug Discovery

  Kaski, S. (Principal investigator), Masood, A. (Project Member) & Nahal, Y. (Project Member)

  01/01/2021 → 31/12/2024

  Project: EU H2020 MC

  • Active Learning 100%
  • Bidirectional Encoder Representations From Transformers 83%
  • Training Data 50%
  • Human-in-the-Loop 44%
  • Predictive Performance 36%