Ab initio study of hydrogen-bond formation between cyclic ethers and selected amino acid side chains

Journal of Physical Chemistry A

Volumn 110, Issue 51, 2006, Pages 13923-13932

  Nagy, Peter I ^a   Erhardt, Paul W ^a  

^a UNIVERSITY OF TOLEDO   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

BASIS SET SUPERPOSITION ERROR (BSSE); GEOMETRY OPTIMIZATION; IONIC SPECIES;

AMINO ACIDS; BINDING ENERGY; COMPLEXATION; HORMONES; HYDROGEN BONDS; MOLECULAR DYNAMICS;

ETHERS;

AMINO ACID; ETHER DERIVATIVE; IMIDAZOLE; IMIDAZOLE DERIVATIVE;

ALGORITHM; ARTICLE; CHEMICAL STRUCTURE; CHEMISTRY; HYDROGEN BOND; METABOLISM; THERMODYNAMICS;

ALGORITHMS; AMINO ACIDS; ETHERS, CYCLIC; HYDROGEN BONDING; IMIDAZOLES; MODELS, MOLECULAR; MOLECULAR STRUCTURE; THERMODYNAMICS;

EID: 33846360654     PISSN: 10895639     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp061113t     Document Type: Article

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