Can docking scoring functions guarantee success in virtual screening?
Yendrek Velásquez-López, Eduardo Tejera, Yunierkis Pérez‐Castillo
Topics & Concepts
Virtual screeningComputer scienceRanking (information retrieval)Machine learningDrug discoveryDocking (animal)Identification (biology)Artificial intelligenceData miningBioinformaticsBiologyMedicineBotanyNursingComputational Drug Discovery MethodsMachine Learning in Materials ScienceProtein Structure and Dynamics