Quantum computational investigations and molecular docking studies on amentoflavone

Quantum computational investigations and molecular docking studies on amentoflavone

Chagas disease is a neglected tropical disease caused by the protozoan parasite Trypanosoma cruzi, with approximately 6–7 million people infected worldwide, becoming a public health problem in tropical countries, thus generating an increasing demand for the development of more effective drugs, due t...

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Bibliographic Details
Main Authors: Márcia M. Marinho, Francisco Wagner Q. Almeida-Neto, Emanuelle M. Marinho, Leonardo P. da Silva, Ramon R.P.P.B. Menezes, Ricardo P. dos Santos, Emmanuel S. Marinho, Pedro de Lima-Neto, Alice M.C. Martins
Format: Article
Language:English
Published: Elsevier 2021-01-01
Series:Heliyon
Subjects:
Antichagasic agent
Biflavonoid
DFT
Fukui analysis
NLO
Online Access:http://www.sciencedirect.com/science/article/pii/S2405844021001845

Internet

http://www.sciencedirect.com/science/article/pii/S2405844021001845

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