Multi-task learning models for predicting active compounds
Zhili Zhao, Jian Qin, Zhuoyue Gou, Yanan Zhang, Yi Yang
Topics & Concepts
Quantitative structure–activity relationshipComputer scienceMachine learningArtificial intelligenceTask (project management)PubChemDrug discoveryComputational modelFeature (linguistics)Biological dataPredictive modellingData miningBioinformaticsComputational biologyBiologyEconomicsPhilosophyLinguisticsManagementComputational Drug Discovery MethodsMachine Learning in Materials ScienceProtein Structure and Dynamics