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Molecular Informatics|August 3, 2016
Analysis of PPAR-α/γ Activity by Combining 2-D QSAR and Molecular SimulationTheodosia Vallianatou, George Lambrinidis, Costas Giaginis, et al.Molecular Informatics|August 3, 2016
The Use of Rule-Based and QSPR Approaches in ADME Profiling: A Case Study on Caco-2 PermeabilityHai Pham-The, Isabel González-Álvarez, Marival Bermejo, et al.Molecular Informatics|August 3, 2016
Modelling Structure Activity Landscapes with Cliffs: a Kernel Regression-Based ApproachCleo Tebby, Enrico MombelliMolecular Informatics|August 3, 2016
Pharmacophore Alignment Search Tool (PhAST): Significance Assessment of Chemical SimilarityVolker Hähnke, Matthias Rupp, Alexander K Hartmann, et al.Molecular Informatics|August 4, 2016
Modeling the Biodegradability of Chemical Compounds Using the Online CHEmical Modeling Environment (OCHEM)Susann Vorberg, Igor V TetkoMolecular Informatics|August 4, 2016
'Quasi-Mixture' Descriptors for QSPR Analysis of Molecular Macroscopic Properties. The Critical Properties of Organic CompoundsE Mokshyna, V I Nedostup, P G Polishchuk, et al.Molecular Informatics|August 4, 2016
Molecular Dynamics of Major Allergens from Alternaria, Birch Pollen and PeachMaría Garrido-Arandia, Cristina Gómez-Casado, Araceli Díaz-Perales, et al.Molecular Informatics|August 4, 2016
Interaction of Flaviviruses with Reproduction Inhibitors Binding in β-OG Pocket: Insights from Molecular Dynamics SimulationsEvgenia V Dueva, Dmitry I Osolodkin, Liubov I Kozlovskaya, et al.Molecular Informatics|August 4, 2016
Data Mining of Chemogenomics Data Using Bi-Modal PLS Methods and Chemical Interpretation for Molecular DesignKiyoshi Hasegawa, Kimito FunatsuMolecular Informatics|August 4, 2016
Multivariate Analysis of Side Effects of Drug Molecules Based on Knowledge of Protein Bindings and ProteinProtein InteractionsKiyoshi Hasegawa, Kimito FunatsuPageof 101