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Graph-neural-networks
CH485---Artificial-Intelligence-and-Chemistry
CH485 - Artificial Intelligence and ChemistryBayesian-deep-learning
Notes and codes of the topic "Bayesian deep learning"uq_molecule
Uncertainty quantification of molecular property prediction using Bayesian deep learningmutual_information_and_self-supervised_learning
Notes and tutorials on "Mutual information and self-supervised learning"multiple_instance_learning
Multiple instance learning for weakly supervised learningMolecular-GAT
Molecular-GATACE-Team-DLstudy
Study materials about "Deep Learning for Molecular Applications".my-study-materials
Semi-supervised-learning
Notes and codes of the topic "Semi-supervised learning"LAIDD_GNN
gnn_solubility
mol_reliability
"A Comprehensive study on the reliability of neural prediction models for virtual screening"seongokryu.github.io
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