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Explorations on the multidimensional potential energy surface of a chiral stationary phase

 

作者: Kenny B. Lipkowitz,   David A. Demeter,   Jo. M. Landwer,   Carol A. Parish,   Thomas Darden,  

 

期刊: Journal of Computational Chemistry  （WILEY Available online 1988）
卷期: Volume 9, issue 1  

页码: 63-66

 

ISSN:0192-8651

 

年代: 1988

 

DOI:10.1002/jcc.540090108

 

出版商: John Wiley&Sons, Inc.

 

数据来源: WILEY

 

摘要:

AbstractThe multidimensional potential energy surface for a soluble analog of a chiral phase is computed with MM2 and MNDO. Minimum energy conformations are located. The minimum energy reaction pathway between these forms is located, and the templating ability of these phases is described.

 

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