Development of a read-across-derived classification model for the predictions of mutagenicity data and its comparison with traditional QSAR models and expert systems
Sapna Kumari Pandey, Kunal Roy
Topics & Concepts
Quantitative structure–activity relationshipInterpretabilityLinear discriminant analysisArtificial intelligenceMachine learningTransferabilityComputer scienceMolecular descriptorBenchmark (surveying)LogitGeodesyGeographyComputational Drug Discovery MethodsChemistry and Chemical EngineeringCholinesterase and Neurodegenerative Diseases