Experimental characterization and molecular dynamic simulation of Ketoprofen-Cyclodextrin complexes
Chemical Physics Letters（2019）
摘要
•Molecular dynamic simulation combines with experimental methods.•The molecular interactions between Ketoprofen and six kinds of cyclodextrin.•Reveal the molecular mechanism of drug-cyclodextrin complexes.
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关键词
Ketoprofen,Cyclodextrin complexation,Molecular dynamic simulation,Molecular mechanism,Binary system
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