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Journal of Chemical Information and Modeling|February 4, 2016
Assessing the Growth of Bioactive Compounds and Scaffolds over Time: Implications for Lead Discovery and Scaffold HoppingSwarit Jasial, Ye Hu, Jürgen BajorathJournal of Chemical Information and Modeling|February 4, 2016
Optimized Virtual Screening Workflow for the Identification of Novel G-Quadruplex LigandsTeresa Kaserer, Riccardo Rigo, Philipp Schuster, et al.Journal of Chemical Information and Modeling|February 6, 2016
Discovery of Novel Nonactive Site Inhibitors of the Prothrombinase Enzyme ComplexKaran Kapoor, Nicole McGill, Cynthia B Peterson, et al.Journal of Chemical Information and Modeling|May 25, 2016
A Historical Excursus on the Statistical Validation Parameters for QSAR Models: A Clarification Concerning Metrics and TerminologyPaola Gramatica, Alessandro SangionJournal of Chemical Information and Modeling|June 2, 2016
Protease Inhibitors in View of Peptide Substrate DatabasesBirgit J Waldner, Julian E Fuchs, Michael Schauperl, et al.Journal of Chemical Information and Modeling|April 5, 2016
Simulation-Based Approaches for Determining Membrane Permeability of Small CompoundsChristopher T Lee, Jeffrey Comer, Conner Herndon, et al.Journal of Chemical Information and Modeling|February 26, 2016
Identification of New Human Malaria Parasite Plasmodium falciparum Dihydroorotate Dehydrogenase Inhibitors by Pharmacophore and Structure-Based Virtual ScreeningElumalai Pavadai, Farah El Mazouni, Sergio Wittlin, et al.Journal of Chemical Information and Modeling|July 18, 2015
Data Quality in the Human and Environmental Health Sciences: Using Statistical Confidence Scoring to Improve QSAR/QSPR ModelingFabian P Steinmetz, Judith C Madden, Mark T D CroninJournal of Chemical Information and Modeling|August 9, 2016
Tertiary Element Interaction in HIV-1 TARKonrad Krawczyk, Adelene Y L Sim, Bernhard Knapp, et al.Journal of Chemical Information and Modeling|April 21, 2015
Transport behavior of a single Ca(2+), K(+), and Na(+) in a water-filled transmembrane cyclic peptide nanotubeXiliang Yan, Jianfen Fan, Yi Yu, et al.Pageof 909