Molecular Graphs
3 projects
Showing 3 of 3 projects
DGL-LifeSciPython
A Python package for applying graph neural networks to molecular graphs and biological networks in life science research.
#graph-neural-networks#cheminformatics#dgl
Stars803
Forks159
Last commit2 years ago
OpenChemPython
A deep learning toolkit for computational chemistry and drug design research with PyTorch backend.
#research-toolkit#qsar#deep-learning
Stars745
Forks121
Last commit2 years ago
GraphDTAPython
GraphDTA predicts drug-target binding affinity using graph neural networks for drug discovery.
#graph-neural-networks#binding-affinity-prediction#deep-learning
Stars300
Forks96
Last commit5 years ago
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