Classification models and SAR analysis on HDAC1 inhibitors using machine learning methods
Rourou Li, Yujia Tian, Zhenwu Yang, Yueshan Ji, Jiaqi Ding, Aixia Yan
Topics & Concepts
Random forestArtificial intelligenceSupport vector machineHydroxamic acidHDAC1Test setComputer scienceArtificial neural networkMachine learningHistone deacetylasePattern recognition (psychology)Computational biologyChemistryBiologyHistoneStereochemistryBiochemistryGeneHistone Deacetylase Inhibitors ResearchComputational Drug Discovery MethodsCholinesterase and Neurodegenerative Diseases