Coupling of the amide I modes of the glycine dipeptide

被引:135
作者
Hamm, P [1 ]
Woutersen, S [1 ]
机构
[1] Max Born Inst Nichtlineare Optik & Kurzzeitspektr, D-12489 Berlin, Germany
关键词
D O I
10.1246/bcsj.75.985
中图分类号
O6 [化学];
学科分类号
0703 ;
摘要
Several approaches to calculate the coupling between the two amide I modes of the glycine dipeptide are compared. The full (phi, psi) conformational space of the molecule is explored, and conditions for the validity of the different approaches are discussed.
引用
收藏
页码:985 / 988
页数:4
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