A lazy learning-based QSAR classification study for screening potential histone deacetylase 8 (HDAC8) inhibitors - Cao, G.P.; Arooj, M.; Thangapandian, S.; Park, C.; Arulalapperumal, V.; Kim, Y.; Kwon, Y.J.; Kim, H.H.; Suh, J.K.; Lee, K.W. (SAR and QSAR in environmental research, 2015)
Keywords: Databases, Chemical; Drug Discovery; Histone Deacetylase Inhibitors - chemistry; Histone Deacetylases - chemistry; histone deacetylases 8; K nearest neighbours; Machine Learning; MD simulation; Models, Chemical; molecular docking; Molecular Dynamics Simulation; neighbourhood classifier; Principal Component Analysis; Quantitative Structure-Activity Relationship; virtual screening; MD simulation; histone deacetylases 8; molecular docking; neighbourhood classifier; virtual screening; K nearest neighbours