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Computer-Aided Drug Design Studies in Association with in Vitro Antileishmanial Tests for New Chalcones

Gleice R. da Silva, Francisnaira S. Santos, Fernando F. Leite, Chonny A. H. Acevedo,Natalia F. de Sousa,Gabriela B. Grimaldi,Milena B. P. Soares,Elisalva T. Guimaraes,Marcus T. Scotti, Luis Cezar Rodrigues,Francisco J. B. Mendonca Junior, Eloisa H. Campana,Jose M. Barbosa Filho, Hemerson I. F. Guimaraes,Felipe Q. S. Guerra

JOURNAL OF THE BRAZILIAN CHEMICAL SOCIETY(2025)

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Key words
flavonoids,computer-aided drug design,homology modeling,molecular docking,pharmacological activity,MolPredictX
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