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SMPLIP-Score: predicting ligand binding affinity from simple and interpretable on-the-fly interaction fingerprint pattern descriptors.

Surendra KumarMi-Hyun Kim
Published in: J. Cheminformatics (2021)
Keyphrases
  • user interaction
  • lookup table
  • neural network
  • multiscale
  • d objects
  • pattern matching
  • texture analysis