DFT QM/MM MD Calculations to Identify Intermolecular Interactions within the Active Sites of MraYAA Bound to Antibiotics Capuramycin, Carbacaprazamycin, and 3′‐Hydroxymureidomycin A.

Autor: Astani, Elahe K.1,2 (AUTHOR) Eastani@hotmail.com, Malek Zadeh, Saeid3,4,5 (AUTHOR), Sardari, Soroush1 (AUTHOR), Khosravian, Mahnaz2 (AUTHOR)
Zdroj: ChemistrySelect. 12/12/2023, Vol. 8 Issue 46, p1-23. 23p.
Databáze: Academic Search Ultimate
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