From traditional to data-driven medicinal chemistry: A case study
Ryo Kunimoto, Jürgen Bajorath, Kazumasa Aoki
Topics & Concepts
Drug discoveryData sciencePharmaceutical sciencesTask (project management)Computer scienceBig dataManagement scienceChemistryEngineeringMedicinePharmacologyData miningSystems engineeringBiochemistryComputational Drug Discovery MethodsGenetics, Bioinformatics, and Biomedical ResearchScientific Computing and Data Management