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Molecular Informatics|July 28, 2016
Probing Small-Molecule Binding to the Liver-X Receptor: A Mixed-Model QSAR StudyMorena Spreafico, Martin Smiesko, Ourania Peristera, et al.
Molecular Informatics|July 28, 2016
A Statistical Survey on the Binding Constants of Covalently Bound Protein-Ligand ComplexesXun Li, Zhihai Liu, Yan Li, et al.
Molecular Informatics|July 28, 2016
Exhaustive Structure Generation for Inverse-QSPR/QSARTomoyuki Miyao, Masamoto Arakawa, Kimito Funatsu
Molecular Informatics|July 28, 2016
Missing Value Estimation for Compound-Target Activity DataYusuf Tanrikulu, Rama Kondru, Gisbert Schneider, et al.
Molecular Informatics|July 28, 2016
Quantitative Structure-Fluorescence Property Relationship Analysis of a Large BODIPY LibraryAndreas Schüller, Garrett Benjamin Goh, Hanjo Kim, et al.
Molecular Informatics|July 29, 2016
BIGCHEM: Challenges and Opportunities for Big Data Analysis in ChemistryIgor V Tetko, Ola Engkvist, Uwe Koch, et al.
Molecular Informatics|July 29, 2016
Computational-Regulatory Developments in the Prediction of Oral Drug AbsorptionG Valsami, P Macheras
Molecular Informatics|July 29, 2016
Multi-pH QSAR: II. Regression Analysis Sensitive Enough to Determine the Transition-State pKa of Human Buccal AbsorptionRobert A Scherrer
Molecular Informatics|July 29, 2016
Targeting PKC-β II and PKB Connection: Design of Dual InhibitorsKapil Jain, Dara Ajay, M Elizabeth Sobhia
Molecular Informatics|July 29, 2016
Differential Virtual Screening (DVS) with Active and Inactive Molecular Models for Finding and Profiling GPCR Modulators: Case of the CCK1 ReceptorConstantino Diaz, Pascal Leplatois, Patricia Angelloz-Nicoud, et al.
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