Concepedia

Molecular docking, ADMET analysis, and bioactivity studies of phytochemicals from Phyllanthus niruri as potential inhibitors of hepatitis C virus NSB5 polymerase

Ibrahim Olaide Adedotun, Misbaudeen Abdul-Hammed, Baliqis Adeola Hamzat, Adewusi John Adepoju, Modinat Wuraola Akinboade, Tolulope Irapada Afolabi, Ubeydat Temitope Ismail

Journal of the Indian Chemical Society · 2021 · 24 citations · 22 references

DOI

Concepts

References

22

The Protein Data Bank

Helen M. Berman · Nucleic Acids Research · 2000 · 39.8K citations

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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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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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PubChem Substance and Compound databases

Sunghwan Kim, Paul Thiessen, Evan Bolton et al. · Nucleic Acids Research · 2015 · 5.5K citations · Full text

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admetSAR: A Comprehensive Source and Free Tool for Assessment of Chemical ADMET Properties

Feixiong Cheng, Weihua Li, Yadi Zhou et al. · Journal of Chemical Information and Modeling · 2012 · 2.2K citations

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