Litcius/Paper detail

Traversing chemical space with active deep learning for low-data drug discovery

Derek van Tilborg, Francesca Grisoni

2024Nature Computational Science29 citationsDOIOpen Access PDF

Topics & Concepts

TraverseChemical spaceDrug discoverySpace (punctuation)Computer scienceDrugArtificial intelligenceMedicinePharmacologyBiologyGeographyBioinformaticsCartographyOperating systemComputational Drug Discovery MethodsMachine Learning in Materials ScienceCell Image Analysis Techniques