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. 2023 Oct 11;14:6378. doi: 10.1038/s41467-023-42032-9

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© The Author(s) 2023

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Fig. 8 — The numbers in the parentheses are the free energies in kcal/mol, computed at SMD(EtOAc)/BMK/def2-TZVPP//B3LYP/def2-SVP, all the structures are obtained in the gas phase.