Insights of structure-based virtual screening and MPO-based SAR analysis of berberine-benzimidazole derivatives against Parkinson disease
Victor Moreira de Oliveira, Matheus Nunes da Rocha, Caio Henrique Alexandre Roberto, Francisco Nithael Melo Lúcio, Márcia Machado Marinho, Emmanuel Silva Marinho, Selene Maia de Morais
Topics & Concepts
BerberineChemistryBenzimidazoleParkinson's diseaseVirtual screeningPharmacologyDiseaseCombinatorial chemistryStereochemistryBiochemistryOrganic chemistryInternal medicinePharmacophoreMedicineComputational Drug Discovery MethodsMachine Learning in BioinformaticsProtein Structure and Dynamics