Comparative Molecular Field Analysis (CoMFA) and Comparative Molecular Similarity Indices Analysis (CoMSIA) Studies on α1A-Adrenergic Receptor Antagonists Based on Pharmacophore Molecular Alignment

Comparative Molecular Field Analysis (CoMFA) and Comparative Molecular Similarity Indices Analysis (CoMSIA) Studies on α1A-Adrenergic Receptor Antagonists Based on Pharmacophore Molecular Alignment

The α1A-adrenergic receptor (α1A-AR) antagonist is useful in treating benign prostatic hyperplasia, lower urinary tract symptoms, and cardiac arrhythmia. Three-dimensional quantitative structure-activity relationship (3D-QSAR) studies were performed on a set of α1A-AR antagonists of N-aryl and N-nit...

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Bibliographic Details
Main Authors: Mu Yuan, Minsheng Chen, Biyun Huang, Xin Zhao, Hong Ji
Format: Article
Language:English
Published: MDPI AG 2011-10-01
Series:International Journal of Molecular Sciences
Subjects:
CoMFA
CoMSIA
pharmacophore-based molecular alignment
α1A-adrenoceptor antagonists
GALAHAD
activity prediction
Online Access:http://www.mdpi.com/1422-0067/12/10/7022/

Internet

http://www.mdpi.com/1422-0067/12/10/7022/

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