Protein-ligand interaction graphs: Learning from ligand-shaped 3D interaction graphs to improve binding affinity prediction

Ижил төстэй зүйлс

• Learning from the ligand: using ligand-based features to improve binding affinity prediction
  -н: Boyles, F, зэрэг
  Хэвлэсэн: (2019)
• Learning from the ligand: using ligand-based features to improve binding affinity prediction
  -н: Boyles, F, зэрэг
  Хэвлэсэн: (2019)
• Development of a graph convolutional neural network model for efficient prediction of protein-ligand binding affinities.
  -н: Jeongtae Son, зэрэг
  Хэвлэсэн: (2021-01-01)
• CurvAGN: Curvature-based Adaptive Graph Neural Networks for Predicting Protein-Ligand Binding Affinity
  -н: Jianqiu Wu, зэрэг
  Хэвлэсэн: (2023-10-01)
• graphDelta: MPNN Scoring Function for the Affinity Prediction of Protein–Ligand Complexes
  -н: Dmitry S. Karlov, зэрэг
  Хэвлэсэн: (2020-03-01)