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Pharmacophore Modeling and Density Functional Theory Analysis for A Series of Nitroimidazole Compounds with Antitubercular Activity

✍ Scribed by Nilesh R. Tawari; Mariam S. Degani


Book ID
111369008
Publisher
John Wiley and Sons
Year
2011
Tongue
English
Weight
909 KB
Volume
78
Category
Article
ISSN
1747-0277

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## Abstract A five point pharmacophore was generated using PHASE for a series of nitroaromatic compounds and their congeners as antitubercular agents. The generated pharmacophore yielded significant 3D‐QSAR model with __r__^2^ of 0.890 for a training set of 92 molecules. The model also showed excel