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Finding structural requirements of structurally diverse α-glucosidase and α-amylase inhibitors through validated and predictive 2D-QSAR and 3D-QSAR analyses

Soumya Mitra, Subhadas Chatterjee, Shobhan Bose, Parthasarathi Panda, Souvik Basak, Nilanjan Ghosh, Subhash C. Mandal, Saroj Singhmura, Amit Kumar Halder

2023Journal of Molecular Graphics and Modelling14 citationsDOI

Topics & Concepts

Quantitative structure–activity relationshipChemistryCheminformaticsSteric effectsDocking (animal)Computational biologyAmylaseStereochemistryComputational chemistryEnzymeBiochemistryBiologyMedicineNursingComputational Drug Discovery MethodsNatural Antidiabetic Agents StudiesEnzyme Production and Characterization
Finding structural requirements of structurally diverse α-glucosidase and α-amylase inhibitors through validated and predictive 2D-QSAR and 3D-QSAR analyses | Litcius