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GSAML-DTA: An interpretable drug-target binding affinity prediction model based on graph neural networks with self-attention mechanism and mutual information

Jiaqi Liao, Haoyang Chen, Lesong Wei, Leyi Wei

2022Computers in Biology and Medicine51 citationsDOI

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Computer scienceArtificial intelligenceMutual informationMechanism (biology)GraphArtificial neural networkMachine learningData miningBenchmark (surveying)Construct (python library)Interaction informationCheminformaticsChemistryTheoretical computer scienceMathematicsComputational chemistryEpistemologyStatisticsPhilosophyGeographyGeodesyProgramming languageComputational Drug Discovery MethodsProtein Structure and DynamicsChemical Synthesis and Analysis
GSAML-DTA: An interpretable drug-target binding affinity prediction model based on graph neural networks with self-attention mechanism and mutual information | Litcius