Orbital interactions and charge redistribution in weak hydrogen bonds: Watson-Crick GC mimic involving C-H proton donor and F proton acceptor groups

International Journal of Quantum Chemistry

Volumn 106, Issue 12, 2006, Pages 2428-2443

  Guerra, Célia Fonseca ^a   Baerends, Evert Jan ^a   Bickelhaupt, F Matthias ^a  

^a VU UNIVERSITY AMSTERDAM   (Netherlands)

Author keywords

Charge transfer; Density functional calculations; DNA base mimics; DNA replicaton; Hydrogen bonds

Indexed keywords

CHARGE TRANSFER; DECOMPOSITION; DNA; PROBABILITY DENSITY FUNCTION; PROTONS; QUANTUM THEORY;

DENSITY FUNCTIONAL CALCULATIONS; DNA BASE MIMICS; DNA REPLICATON;

HYDROGEN BONDS;

EID: 33748435748     PISSN: 00207608     EISSN: 1097461X     Source Type: Journal    
DOI: 10.1002/qua.21039     Document Type: Article

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