Theoretical method for full ab Initio calculation of DNA/RNA-ligand interaction energy

Journal of Chemical Physics

Volumn 120, Issue 24, 2004, Pages 11386-11391

  Chen, Xi H ^a   Zhang, John Z H ^a  

^a NEW YORK UNIVERSITY   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

CONJUCATED CAPS; DNA/RNA-LIGAND; INTERACTION ENERGIES; MOLECULAR FRACTIONATION;

APPROXIMATION THEORY; DECOMPOSITION; DNA; GENETIC ENGINEERING; HYDROGEN BONDS; NEGATIVE IONS; NUCLEIC ACIDS; PHOSPHATES; PROTEINS; RNA; WATER;

QUANTUM THEORY;

ANION; DNA; DOUBLE STRANDED RNA; LIGAND; OLIGONUCLEOTIDE; ORGANOPHOSPHORUS COMPOUND; PHOSPHORIC ACID DIMETHYL ESTER; RNA; WATER;

ALGORITHM; ARTICLE; BASE PAIRING; BINDING SITE; CHEMICAL MODEL; CHEMISTRY; QUANTUM THEORY; THERMODYNAMICS;

ALGORITHMS; ANIONS; BASE PAIRING; BINDING SITES; DNA; LIGANDS; MODELS, CHEMICAL; OLIGONUCLEOTIDES; ORGANOPHOSPHORUS COMPOUNDS; QUANTUM THEORY; RNA; RNA, DOUBLE-STRANDED; THERMODYNAMICS; WATER;

EID: 3142764007     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.1737295     Document Type: Article

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