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Molecular docking and simulation studies on SARS-CoV-2 M<sup>pro</sup> reveals Mitoxantrone, Leucovorin, Birinapant, and Dynasore as potent drugs against COVID-19

Kiran Bharat Lokhande, Sayali Doiphode, Renu Vyas, K. Venkateswara Swamy

2020Journal of Biomolecular Structure and Dynamics125 citationsDOIOpen Access PDF

Abstract

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Topics & Concepts

Molecular dynamicsPubChemDocking (animal)Drug repositioningChemistryDrugCombinatorial chemistryPharmacologyMedicineBiochemistryComputational chemistryNursingComputational Drug Discovery MethodsSynthesis and biological activitySARS-CoV-2 and COVID-19 Research
Molecular docking and simulation studies on SARS-CoV-2 M<sup>pro</sup> reveals Mitoxantrone, Leucovorin, Birinapant, and Dynasore as potent drugs against COVID-19 | Litcius