引用本文:
Meng Yan NIE, Liang Mo ZHOU, Qing Hai WANG, Dao Qian ZHU. Molecular Dynamic Study for Chiral Discrimination of α-Phenylethylamine by Modified Cyclodextrin in Gas Chromatography[J]. Chinese Chemical Letters,
2000, 11(4): 347-350.
Citation: Meng Yan NIE, Liang Mo ZHOU, Qing Hai WANG, Dao Qian ZHU. Molecular Dynamic Study for Chiral Discrimination of α-Phenylethylamine by Modified Cyclodextrin in Gas Chromatography[J]. Chinese Chemical Letters, 2000, 11(4): 347-350.
Citation: Meng Yan NIE, Liang Mo ZHOU, Qing Hai WANG, Dao Qian ZHU. Molecular Dynamic Study for Chiral Discrimination of α-Phenylethylamine by Modified Cyclodextrin in Gas Chromatography[J]. Chinese Chemical Letters, 2000, 11(4): 347-350.
Molecular Dynamic Study for Chiral Discrimination of α-Phenylethylamine by Modified Cyclodextrin in Gas Chromatography
摘要:
A molecular dynamic method in conjunction with a statistic test has been utilized to model chiral recognition of α-phenylethylamine on heptakis (2,6-di-O-butyl-3-O-butyryl)-β-cyclodextrin in gas chromatography. The modelling data correlated with the chromatographic elution order, and indicated that the preferred site of α-phenylethylamine is the interior of cavity.
English
Molecular Dynamic Study for Chiral Discrimination of α-Phenylethylamine by Modified Cyclodextrin in Gas Chromatography
Abstract:
A molecular dynamic method in conjunction with a statistic test has been utilized to model chiral recognition of α-phenylethylamine on heptakis (2,6-di-O-butyl-3-O-butyryl)-β-cyclodextrin in gas chromatography. The modelling data correlated with the chromatographic elution order, and indicated that the preferred site of α-phenylethylamine is the interior of cavity.
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Key words:
- Molecular modelling
- / modified cyclodextrin
- / chiral recognition
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