How different is pyrimidine as a core component of DNA base from its diazine isomers: A DFT study?-Reference-Cited by-同舟云学术

How different is pyrimidine as a core component of DNA base from its diazine isomers: A DFT study?

Published:2016-08-22 Issue:24 Volume:116 Page:1836-1845
ISSN:0020-7608
Container-title:International Journal of Quantum Chemistry
language:en
Short-container-title:Int. J. Quantum Chem.

Author:

Chatterjee Subhojyoti¹,Wang Feng¹

Affiliation:

1. Molecular Model Discovery Laboratory; Department of Chemistry and Biotechnology, Faculty of Science, Engineering and Technology, Swinburne University of Technology; Hawthorn, Melbourne Victoria 3122 Australia

Funder

Australia Research Council

Publisher

Wiley

Subject

Physical and Theoretical Chemistry,Condensed Matter Physics,Atomic and Molecular Physics, and Optics

Reference98 articles.

1. Infrared spectra of pyrazine, pyrimidine and pyridazine in solid argon

2. The physicochemical essence of the purine·pyrimidine transition mismatches with Watson-Crick geometry in DNA: A·C*versaA*·C. A QM and QTAIM atomistic understanding

3. The nature of the transition mismatches with Watson–Crick architecture: the G*·T or G·T* DNA base mispair or both? A QM/QTAIM perspective for the biological problem

4. Geometric and energetic consequences of prototropy for adenine and its structural models – a review

5. An Analysis of the Isomerization Energies of 1,2-/1,3-Diazacyclobutadiene, Pyrazole/Imidazole, and Pyridazine/Pyrimidine with the Turn-Upside-Down Approach

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