Cooperative Binding of Cyclodextrin Dimers to Isoflavone Analogues Elucidated by Free Energy Calculations

[Image: see text] Dimerization of cyclodextrin (CD) molecules is an elementary step in the construction of CD-based nanostructured materials. Cooperative binding of CD cavities to guest molecules facilitates the dimerization process and, consequently, the overall stability and assembly of CD nanostr...

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Bibliografiske detaljer
Main Authors: Zhang, Haiyang, Tan, Tianwei, Hetényi, Csaba, Lv, Yongqin, van der Spoel, David
Format: Artigo
Sprog:Inglês
Udgivet: American Chemical Society 2014
Online adgang:https://ncbi.nlm.nih.gov/pmc/articles/PMC3977494/
https://ncbi.nlm.nih.gov/pubmed/24719673
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/jp412041d
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