Calculation of the potential energy surface for intermolecular amide hydrogen bonds using semiempirical and ab initio methods

Journal of the American Chemical Society

Volumn 118, Issue 33, 1996, Pages 7689-7693

  Adalsteinsson, Helgi ^a   Maulitz, Andreas H ^a   Bruice, Thomas C ^a  

^a UNIVERSITY OF CALIFORNIA   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

AMIDE;

ARTICLE; CALCULATION; DRUG STRUCTURE; MOLECULAR DYNAMICS; THEORY;

EID: 0029815959     PISSN: 00027863     EISSN: None     Source Type: Journal    
DOI: 10.1021/ja954267n     Document Type: Article

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