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Geometric graph learning with extended atom-types features for protein-ligand binding affinity prediction.
Md. Masud Rana
Duc Duy Nguyen
Published in:
Comput. Biol. Medicine (2023)
Keyphrases
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learning process
learning algorithm
feature extraction
feature vectors
machine learning
prior knowledge
active learning
supervised learning
prediction accuracy
directed graph
amino acids
geometric information
contact map