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(a) Snapshots of the final results of each molecular dynamics simulation between γ-CDPVAHMA and NFD in methanol and in environment of acid and neutral-basic pH. Snapshots of the main intermolecular interactions generated between γ-CDPVAHMA and NFD: (b) in superficial nano-cavities of the hydrogel; (c) with the hydrophobic cavities of γ-CD added to the hydrogel; and (d,e) front and back face of the γ-CD/NFD inclusion complex.
