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PEARL -- CACO2 -- rank 1: PC-only

Part of the PEARL benchmark (Parameter-Efficient Adaptation with Retrieval-Augmented Learning for Molecular Property Prediction). This is the #1 best-performing method on CACO2 (regression), ranked by Spearman.

  • Method: PC-only
  • Configuration: CatBoost
  • Spearman: 0.8534

Code: https://github.com/raghvendra5688/PEARL