First report of q-RASAR modeling toward an approach of easy interpretability and efficient transferability
Arkaprava Banerjee, Kunal Roy
Topics & Concepts
InterpretabilityQuantitative structure–activity relationshipSimilarity (geometry)TransferabilityComputer scienceSet (abstract data type)Partial least squares regressionSimilarity measureArtificial intelligenceConcordance correlation coefficientData miningMathematicsMachine learningStatisticsLogitImage (mathematics)Programming languageComputational Drug Discovery MethodsAnalytical Chemistry and ChromatographyPharmacogenetics and Drug Metabolism