Exploration of SAM-I riboswitch inhibitors: In-Silico discovery of ligands to a new target employing multistage CADD approaches

Targeting riboswitches, regulatory elements responsible for the expression of essential genes, is taking central stage in the new era of antibacterial medications discovery due to the emergence of antibiotic resistance. The S-Adenosyl methionine-I (SAM-I) riboswitch works through transcription termi...

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Bibliographic Details

Published in:	Artificial Intelligence Chemistry
Main Authors:	Nada Elkholy, Reham Hassan, Loay Bedda, Mohamed A. Elrefaiy, Reem K. Arafa
Format:	Article
Language:	English
Published:	Elsevier 2024-06-01
Subjects:	SAM-I riboswitch RNA library screening Pharmacophore model Molecular dynamics
Online Access:	http://www.sciencedirect.com/science/article/pii/S2949747724000022