Efficient and accurate theoretical methods to investigate anion-π interactions in protein model structures

Journal of Physical Chemistry B

Volumn 117, Issue 12, 2013, Pages 3315-3322

  Jones, Gareth J ^a   Robertazzi, Arutro ^b   Platts, James A ^a  

^a CARDIFF UNIVERSITY   (United Kingdom)

^b FREIE UNIVERSITÄT BERLIN   (Germany)

Author keywords

[No Author keywords available]

Indexed keywords

BIOCHEMISTRY; DENSITY FUNCTIONAL THEORY; MODEL STRUCTURES; NEGATIVE IONS; PROTEINS;

APPROXIMATE METHODS; ATTRACTIVE INTERACTIONS; BIOCHEMICAL SYSTEMS; DENSITY FUNCTIONAL THEORIES (DFT); EXPERIMENTAL EVIDENCE; INTERACTION ENERGIES; LOCAL APPROXIMATION; SUBSTITUTED BENZENES;

COMPLEXATION;

EID: 84875728149     PISSN: 15206106     EISSN: 15205207     Source Type: Journal    
DOI: 10.1021/jp400345s     Document Type: Article

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