Protonation of base Pairs in RNA: Context analysis and quantum chemical investigations of their geometries and stabilities

Journal of Physical Chemistry B

Volumn 115, Issue 6, 2011, Pages 1469-1484

  Chawla, Mohit ^a,b   Sharma, Purshotam ^a,b   Halder, Sukanya ^c   Bhattacharyya, Dhananjay ^c   Mitra, Abhijit ^a  

^a INTERNATIONAL INSTITUTE OF INFORMATION TECHNOLOGY   (India)

^b LOVELY PROFESSIONAL UNIVERSITY   (India)

^c SAHA INSTITUTE OF NUCLEAR PHYSICS   (India)

Author keywords

[No Author keywords available]

Indexed keywords

BIOINFORMATICS; CHEMICAL ANALYSIS; COMPLEXATION; HYDROGEN BONDS; NUCLEIC ACIDS; OPTIMIZATION; PROTONATION; QUANTUM CHEMISTRY; RNA;

BASE PAIRS; CONFORMATIONAL CHANGE; CONTEXT ANALYSIS; DATA SETS; ENERGY DECOMPOSITION; GASPHASE; GEOMETRICAL PARAMETERS; H-BONDING; HARTREE-FOCK; HIGHER-ORDER STRUCTURE; INTERACTION ENERGIES; INTERMOLECULAR INTERACTIONS; KEY ELEMENTS; MOLECULAR SWITCHES; NUCLEOBASES; PROTONATED; QUANTUM CHEMICAL ANALYSIS; QUANTUM CHEMICAL COMPUTATIONS; QUANTUM CHEMICAL INVESTIGATION; RNA MOLECULES; STRUCTURAL AMBIGUITY; THEORETICAL MODELS; TOTAL INTERACTION ENERGY;

GEOMETRY;

EID: 79951544368     PISSN: 15206106     EISSN: 15205207     Source Type: Journal    
DOI: 10.1021/jp106848h     Document Type: Article

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