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Molecular Informatics|July 29, 2016
Addressing the Conformational Flexibility of Serine Racemase by Combining Targeted Molecular Dynamics, Conformational Sampling and Docking StudiesAgostino Bruno, Laura Amori, Gabriele CostantinoMolecular Informatics|July 29, 2016
MHC Class II Binding Prediction by Molecular DockingM Atanasova, I Dimitrov, D R Flower, et al.Molecular Informatics|July 29, 2016
In Silico Studies of the Relationship Between Chemical Structure and Drug Induced PhospholipidosisKatarzyna R Przybylak, Mark T D CroninMolecular Informatics|July 29, 2016
Molecular Dynamics Simulations Using Graphics Processing UnitsJohn A Baker, Jonathan D HirstMolecular Informatics|July 29, 2016
Text Mining for Drugs and Chemical Compounds: Methods, Tools and ApplicationsMiguel Vazquez, Martin Krallinger, Florian Leitner, et al.Molecular Informatics|July 29, 2016
Computational Insights into Ligand Selectivity of Estrogen Receptors from Pharmacophore ModelingJing Fang, Jie Shen, Feixiong Cheng, et al.Molecular Informatics|July 29, 2016
Rule-Based Classification of Chemical Structures by ScaffoldAnsgar Schuffenhauer, Thibault VarinMolecular Informatics|July 29, 2016
Electrostatic Similarity Determination Using Multiresolution AnalysisHuseyin Hakkoymaz, Chris A Kieslich, Ronald D Gorham, et al.Molecular Informatics|August 2, 2016
Wine Compounds as a Source for HTS Screening Collections. A Feasibility StudyFeng Zhu, Gerard Logan, Jóhannes ReynissonMolecular Informatics|August 2, 2016
Prediction of Bovine Serum Albumin-Water Partition Coefficients of a Wide Variety of Neutral Organic Compounds by Means of Support Vector MachineHassan Golmohammadi, Zahra Dashtbozorgi, William E AcreePageof 101