Zooming into π-stacked manifolds of nucleobases: Ionized states of dimethylated uracil dimers

Journal of Physical Chemistry A

Volumn 114, Issue 4, 2010, Pages 2001-2009

  Zadorozhnaya, Anna A ^a   Krylov, Anna I ^a  

^a UNIVERSITY OF SOUTHERN CALIFORNIA   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

AB INITIO CALCULATIONS; ELECTRONIC SPECTRUM; ELECTROSTATIC INTERACTIONS; IN-PHASE; IONIZATION ENERGIES; IONIZED SPECIES; IONIZED STATE; LOCALIZED HOLES; LONE PAIR; NEUTRAL SPECIES; NONUNIFORM; NUCLEOBASES; ORBITAL OVERLAP; OUT OF PHASE; RED-SHIFTED; RELATIVE ORDER; SPLITTINGS; STACKING INTERACTION; URACIL DIMERS;

ALKYLATION; BINDING ENERGY; ELECTRONIC STRUCTURE; METHYLATION; MONOMERS; OLIGOMERS; SUPERALLOYS;

ISOMERS;

1,3 DIMETHYLURACIL; 1,3-DIMETHYLURACIL; DRUG DERIVATIVE; ION; URACIL;

ARTICLE; CHEMISTRY; COMPUTER SIMULATION; CONFORMATION; DIMERIZATION; THERMODYNAMICS;

COMPUTER SIMULATION; DIMERIZATION; IONS; NUCLEIC ACID CONFORMATION; THERMODYNAMICS; URACIL;

EID: 77249095373     PISSN: 10895639     EISSN: 15205215     Source Type: Journal    
DOI: 10.1021/jp910440d     Document Type: Article

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