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Binding free energy decomposition and multiple unbinding paths of buried ligands in a PreQ(1) riboswitch

Riboswitches are naturally occurring RNA elements that control bacterial gene expression by binding to specific small molecules. They serve as important models for RNA-small molecule recognition and have also become a novel class of targets for developing antibiotics. Here, we carried out convention...

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Detalles Bibliográficos
Autores principales: Hu, Guodong, Zhou, Huan-Xiang
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Public Library of Science 2021
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8612554/
https://www.ncbi.nlm.nih.gov/pubmed/34767553
http://dx.doi.org/10.1371/journal.pcbi.1009603