Performance analysis of activation functions in molecular property prediction using Message Passing Graph Neural Networks
Garima Chanana
Topics & Concepts
ChemistryProperty (philosophy)Artificial neural networkGraphMessage passingBiological systemTheoretical computer scienceDistributed computingArtificial intelligenceComputer sciencePhilosophyBiologyEpistemologyComputational Drug Discovery MethodsMachine Learning in Materials ScienceProtein Structure and Dynamics