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OLB-AC: toward optimizing ligand bioactivities through deep graph learning and activity cliffs.

Yueming YinHaifeng HuJitao YangChun YeWilson Wen Bin GohAdams Wai-Kin KongJiansheng Wu
Published in: Bioinformatics (Oxford, England) (2024)
The code and dataset developed in this work are available at github.com/Yueming-Yin/OLB-AC.
Keyphrases
  • convolutional neural network
  • neural network
  • machine learning