Advanced Editorial to announce a JCAMD Special Issue on Artificial Intelligence and Machine Learning Daniel RekerRichard A. Lewis Editorial 02 December 2019 Pages: 941 - 941
Nonparametric chemical descriptors for the calculation of ligand-biopolymer affinities with machine-learning scoring functions Edelmiro MomanMaria A. GrishinaVladimir A. Potemkin OriginalPaper 14 November 2019 Pages: 943 - 953
Dual-targeted hit identification using pharmacophore screening Galyna P. VolynetsSergiy A. StarosylaMichail A. Tukalo OriginalPaper 06 November 2019 Pages: 955 - 964
Prediction of P-glycoprotein inhibitors with machine learning classification models and 3D-RISM-KH theory based solvation energy descriptors Vijaya Kumar HingeDipankar RoyAndriy Kovalenko OriginalPaper 19 November 2019 Pages: 965 - 971
Discovery of a potential positive allosteric modulator of glucagon-like peptide 1 receptor through virtual screening and experimental study Tejashree RedijJian MaZhijun Li OriginalPaper 22 November 2019 Pages: 973 - 981
A3 adenosine receptor activation mechanisms: molecular dynamics analysis of inactive, active, and fully active states Antonella CiancettaPriscila RubioKenneth A. Jacobson OriginalPaper 22 November 2019 Pages: 983 - 996
Undersampling: case studies of flaviviral inhibitory activities Stephen J. BarigyeJosé Manuel García de la VegaJuan A. Castillo-Garit OriginalPaper 26 November 2019 Pages: 997 - 1008
