Machine Learning for In Silico ADMET Prediction
Lei Jia, Hua Gao
Topics & Concepts
In silicoQuantitative structure–activity relationshipDrug developmentDrug discoveryPharmacodynamicsComputational biologyPharmacokineticsDrugPharmacologyComputer scienceChemistryMachine learningBioinformaticsBiologyBiochemistryGeneComputational Drug Discovery MethodsMetabolomics and Mass Spectrometry StudiesAnalytical Chemistry and Chromatography