Conformational study of the alanine dipeptide at the MP2 and DFT levels

Journal of Physical Chemistry A

Volumn 106, Issue 13, 2002, Pages 3213-3218

  Vargas, Rubicelia ^a   Garza, Jorge ^a   Hay, Benjamin P ^b   Dixon, David A ^b  

^a DEPARTAMENTO DE QUÍMICA   (Mexico)

^b PACIFIC NORTHWEST NATIONAL LABORATORY   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

ALANINE DIPEPTIDE;

CONFORMATIONS; DERIVATIVES; ELECTRONIC STRUCTURE; OPTIMIZATION; PROBABILITY DENSITY FUNCTION;

PROTEINS;

EID: 0037018526     PISSN: 10895639     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp013952f     Document Type: Article

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