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- W1970408600 abstract "The physical and chemical mechanisms of small molecules with pharmacological activity forming nanostructures are developing into a new field of nanomedicine. By using ROESY 2D NMR spectroscopy, tandem mass spectroscopy, transmission electron microscopy, and computer-assisted molecular modeling, this paper demonstrates the contribution of the folded conformation, the intra- and intermolecular π–π stacking, the intra- and intermolecular hydrogen bonds, and the receptor binding free energy of 6-dimethylaminonaph-2-yl-{N-S-[1-benzylcarba-moyl-4-(2-chloroacetamidobutyl)]-carboxamide (YW3-56) to the rapid formation of nanorings and the slow formation of nanocapsules. Thus we have developed a strategy that makes it possible to elucidate the physical and chemical mechanisms of bioactive small molecules forming nanostructures." @default.
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- W1970408600 date "2013-05-03" @default.
- W1970408600 modified "2023-09-26" @default.
- W1970408600 title "Folded Conformation, Cyclic Pentamer, Nanostructure, and PAD4 Binding Mode of YW3-56" @default.
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- W1970408600 doi "https://doi.org/10.1021/jp311726k" @default.
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