Articles with "docking methods" as a keyword



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Use of Network Pharmacology and Molecular Docking Methods to Elucidate the Curative Effect of Epimedium–Anemarrhen on Osteoporosis

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Published in 2022 at "Natural Product Communications"

DOI: 10.1177/1934578x221086904

Abstract: Objective: Using network pharmacology and molecular docking methods, this study aimed to elucidate the key targets and molecular mechanisms of the Epimedium–Anemarrhen (EA) combination as a therapeutic approach for osteoporosis (OP). Methods: The TCMSP database… read more here.

Keywords: molecular docking; network; pharmacology; docking methods ... See more keywords
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Consensus Docking in Drug Discovery

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Published in 2020 at "Current Bioactive Compounds"

DOI: 10.2174/1573407214666181023114820

Abstract: Molecular docking is probably the most popular and profitable approach in computer-aided drug design, being the staple technique for predicting the binding mode of bioactive compounds and for performing receptor-based virtual screening studies. The growing… read more here.

Keywords: virtual screening; consensus docking; consensus; docking methods ... See more keywords
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3D-QSAR Studies of Isatin Derivatives with Anti-Cancer In Vitro: AdvancedCoMFA, CoMSIA and Docking Methods

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Published in 2017 at "Chemical Science"

DOI: 10.4172/2150-3494.1000158

Abstract: Three-dimensional quantitative structure–activity relationship (3D-QSAR) and docking methods were performed to study 47 tubulin inhibitors, isatin derivatives with anticancer activity against human monocyte-like histiocytic lymphoma human U937 cells. The established 3D-QSAR model from Comparative Molecular… read more here.

Keywords: derivatives anti; comsia; docking methods; studies isatin ... See more keywords