期刊
CHEMICAL PHYSICS LETTERS
卷 383, 期 5-6, 页码 566-571出版社
ELSEVIER
DOI: 10.1016/j.cplett.2003.11.084
关键词
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The inclusion complex between the powerful antimalarial agent Artemisinin and beta-cyclodextrin has been studied by means of Circular Dichroism and elucidated by Density Functional Theory calculations on the isolated molecule combined to a statistical Monte Carlo search of the most stable geometry of the complex. The results evidence a host-guest structure in full agreement with the almost unaffected functionality of the drug, which is found to experience a significant hydrophilic environment when complexed. (C) 2003 Elsevier B.V. All rights reserved.
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