Concepedia

Rational drug design and synthesis of new α-Santonin derivatives as potential COX-2 inhibitors

Adriana Coricello, Asma El-Magboub, Marian Luna, Angela Ferrario, Ian S. Haworth, Charles J. Gomer, Francesca Aiello, James D. Adams

Bioorganic & Medicinal Chemistry Letters · 2018 · 21 citations · 20 references

DOI

Concepts

References

20

AutoDock Vina: Improving the speed and accuracy of docking with a new scoring function, efficient optimization, and multithreading

Oleg Trott, Arthur J. Olson · Journal of Computational Chemistry · 2009 · 37.1K citations · Full text

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AutoDock4 and AutoDockTools4: Automated docking with selective receptor flexibility

Garrett M. Morris, Ruth Huey, William Lindstrom et al. · Journal of Computational Chemistry · 2009 · 25K citations · Full text

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Lead- and drug-like compounds: the rule-of-five revolution

Christopher A. Lipinski · Drug Discovery Today Technologies · 2004 · 6.1K citations

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Small-Molecule Library Screening by Docking with PyRx

Sargis Dallakyan, Arthur J. Olson · Methods in molecular biology · 2014 · 3.9K citations

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Antioxidant and Anti-Inflammatory Activities of Flavanones from Glycyrrhiza glabra L. (licorice) Leaf Phytocomplexes: Identification of Licoflavanone as a Modulator of NF-kB/MAPK Pathway

Luca Frattaruolo, Gabriele Carullo, Matteo Brindisi et al. · Antioxidants · 2019 · 164 citations · Full text

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