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Prediction on the mutagenicity of nitroaromatic compounds using quantum chemistry descriptors based QSAR and machine learning derived classification methods

Medicinal ChemistryBioorganic ChemistryMachine LearningEngineeringChemical AnalysisNatural SciencesPredictive ToxicologyMolecular PropertyRational Drug DesignQuantum Chemistry DescriptorsOrganic ChemistryComputational ChemistryChemistryPharmacologyTarget PredictionDrug DiscoveryNitroaromatic Compounds