Magnitude and nature of carbohydrate-aromatic interactions: Ab initio calculations of fucose - benzene complex

Journal of Physical Chemistry B

Volumn 113, Issue 16, 2009, Pages 5617-5621

  Tsuzuki, Seiji ^a,b   Uchimaru, Tadafumi ^a,b   Mikami, Masuhiro ^a,b  

^a NATIONAL INSTITUTE OF ADVANCED INDUSTRIAL SCIENCE AND TECHNOLOGY AIST   (Japan)

^b JAPAN SCIENCE AND TECHNOLOGY AGENCY   (Japan)

Author keywords

[No Author keywords available]

Indexed keywords

AROMATIC COMPOUNDS; BENZENE; BINDING SITES; CARBOHYDRATES; COMPLEXATION; ELECTROSTATICS; HYDROGEN; MOLECULAR ORBITALS;

AB INITIO CALCULATIONS; AB INITIO MOLECULAR ORBITAL CALCULATION; AROMATIC INTERACTIONS; BENZENE RING; C-H BOND; CONTACT STRUCTURE; DISPERSION INTERACTION; E-FORMS; ELECTROSTATIC CONTRIBUTIONS; ELECTROSTATIC INTERACTIONS; HYDROGEN-BONDED COMPLEXES; HYDROGEN-BONDED STRUCTURES; INTERACTION ENERGIES; NON-POLAR SURFACES; OPTIMIZED GEOMETRIES; STABILIZATION ENERGY;

HYDROGEN BONDS;

EID: 66349115086     PISSN: 15206106     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp8093726     Document Type: Article

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