Concepedia

Flavonoids from Pterogyne nitens as Zika virus NS2B-NS3 protease inhibitors

Caroline Sprengel Lima, Melina Mottin, Letícia Ribeiro de Assis, Nathalya Cristina de Moraes Roso Mesquita, Bruna Katiele de Paula Sousa, Laís D. Coimbra, Karina Bispo-dos-Santos, Kimberley M. Zorn, Rafael V. C. Guido, Sean Ekins,

Bioorganic Chemistry · 2021 · 39 citations · 59 references

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References

59

VMD: Visual molecular dynamics

William Humphrey, Andrew Dalke, Klaus Schulten · Journal of Molecular Graphics · 1996 · 66.6K citations

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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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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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<i>MolProbity</i>: all-atom structure validation for macromolecular crystallography

Vincent B. Chen, W.B. Arendall, Jeffrey J. Headd et al. · Acta Crystallographica Section D Biological Crystallography · 2009 · 14.7K citations · Full text

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