Ab initio determination of coarse-grained interactions in double-stranded DNA

Journal of Chemical Physics

Volumn 137, Issue 10, 2012, Pages

  Hsu, Chia Wei ^a   Fyta, Maria ^a,b   Lakatos, Greg ^a,c   Melchionna, Simone ^c,d   Kaxiras, Efthimios ^a,c  

^a HARVARD UNIVERSITY   (United States)

^b TECHNICAL UNIVERSITY OF MUNICH   (Germany)

^c HARVARD UNIVERSITY   (United States)

^d SAPIENZA UNIVERSITY OF ROME   (Italy)

Author keywords

[No Author keywords available]

Indexed keywords

AB INITIO; ANALYTICAL EXPRESSIONS; COARSE GRAINED MODELS; COARSE-GRAINED; DENSITY FUNCTIONAL THEORIES (DFT); DNA NUCLEOTIDES; DNA STRANDS; DOUBLE STRANDED DNA; EXPERIMENTAL DATA; INTERACTION ENERGIES; LENGTH SCALE; PERSISTENCE LENGTH; SEQUENCE SPECIFICITY; STACKING INTERACTION; TIME-SCALES; TOTAL-ENERGY CALCULATIONS; AB INITIO TOTAL ENERGY;

CALCULATIONS; DENSITY FUNCTIONAL THEORY; HYDROGEN BONDS; NUCLEOTIDES; CHEMICAL BONDS; DNA;

DNA; DENSITY FUNCTIONAL THEORY;

DNA;

ARTICLE; CHEMISTRY; QUANTUM THEORY;

DNA; QUANTUM THEORY;

EID: 84866395365     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.4748105     Document Type: Article

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