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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…
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Keywords:
molecular docking;
network;
pharmacology;
docking methods ... See more keywords
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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…
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Keywords:
virtual screening;
consensus docking;
consensus;
docking methods ... See more keywords
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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…
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Keywords:
derivatives anti;
comsia;
docking methods;
studies isatin ... See more keywords