Combined first-principles computational and experimental multinuclear solid-state NMR investigation of amino acids

Journal of Physical Chemistry A

Volumn 109, Issue 31, 2005, Pages 6960-6969

  Gervais, Christel ^a   Dupree, Ray ^b   Pike, Kevin J ^b   Bonhomme, Christian ^a   Profeta, Mickaël ^c   Pickard, Chris J ^d   Mauri, Francesco ^c  

^a UNIVERSITÉ PIERRE ET MARIE CURIE   (France)

^b UNIVERSITY OF WARWICK   (United Kingdom)

^c UNIVERSITÉ PIERRE ET MARIE CURIE   (France)

^d UNIVERSITY OF CAMBRIDGE   (United Kingdom)

Author keywords

[No Author keywords available]

Indexed keywords

BOUNDARY CONDITIONS; CRYSTALLIZATION; HYDROGEN BONDS; MOLECULAR STRUCTURE; NEUTRON DIFFRACTION; NUCLEAR MAGNETIC RESONANCE; PROTONS; QUANTUM THEORY;

CHEMICAL SHIFT TENSORS; COCAINE HYDROCHLORIDE; ELECTRIC FIELD GRADIENT (EFG); ORGANIC MOLECULES;

AMINO ACIDS;

AMINO ACID; CARBON; CHLORINE; ISOTOPE; OXYGEN;

ARTICLE; CHEMICAL STRUCTURE; CHEMISTRY; COMPUTER SIMULATION; CRYSTALLIZATION; HYDROGEN BOND; NUCLEAR MAGNETIC RESONANCE;

AMINO ACIDS; CARBON ISOTOPES; CHLORINE; COMPUTER SIMULATION; CRYSTALLIZATION; HYDROGEN BONDING; ISOTOPES; MODELS, MOLECULAR; MOLECULAR STRUCTURE; NUCLEAR MAGNETIC RESONANCE, BIOMOLECULAR; OXYGEN ISOTOPES;

EID: 23844525163     PISSN: 10895639     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp0513925     Document Type: Article

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