Graph Neural Networks for Molecules
Yuyang Wang, Zijie Li, Amir Barati Farimani
Topics & Concepts
Computer scienceArtificial neural networkMolecular graphGraphArtificial intelligenceNervous system network modelsMachine learningTheoretical computer scienceRecurrent neural networkTypes of artificial neural networksComputational Drug Discovery MethodsMachine Learning in Materials ScienceProtein Structure and Dynamics