Identification of potential inhibitors of SARS-CoV-2 main protease from Aloe vera compounds: A molecular docking study
Pius T. Mpiana, Koto-te-Nyiwa Ngbolua, Damien S. T. Tshibangu, Jason T. Kilembe, Benjamin Z. Gbolo, Domaine T. Mwanangombo, Clément L. Inkoto, Emmanuel M. Lengbiye, Clément M. Mbadiko, Aristote Matondo, Gédéon Ngiala Bongo, Dorothée D. Tshilanda
Topics & Concepts
ProteaseDocking (animal)Lipinski's rule of fiveEnzymeChemistrySevere acute respiratory syndrome coronavirus 2 (SARS-CoV-2)Coronavirus disease 2019 (COVID-19)StereochemistryComputational biologyVirologyBiochemistryBiologyIn silicoInfectious disease (medical specialty)DiseaseMedicineGeneNursingPathologyComputational Drug Discovery MethodsPhytochemistry and biological activity of medicinal plantsFree Radicals and Antioxidants