The influence of isolated and penta-hydrated Zn2+ on some of the intramolecular proton-transfer processes of thymine: a quantum chemical study-Reference-Cited by-同舟云学术

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The influence of isolated and penta-hydrated Zn2+ on some of the intramolecular proton-transfer processes of thymine: a quantum chemical study

Published:2018 Issue:20 Volume:8 Page:11021-11026
ISSN:2046-2069
Container-title:RSC Advances
language:en
Short-container-title:RSC Adv.

Author:

Li Dejie¹²³⁴⁵,Han Ying⁶⁷⁸⁹¹⁰,Li Huijuan¹¹¹²¹³¹⁰,Zhang Ping¹²³⁴⁵,Kang Qi¹²³⁴⁵,Li Zhihua¹²³⁴⁵,Shen Dazhong¹²³⁴⁵^ORCID

Affiliation:

1. College of Chemistry

2. Chemical Engineering and Materials Science

3. Collaborative Innovation Center of Functionalized Probes for Chemical Imaging in Universities of Shandong

4. Key Laboratory of Molecular and Nano Probes

5. Ministry of Education

6. National Engineering Research Center for Colloidal Materials

7. School of Chemistry and Chemical Engineering

8. Shandong University

9. Jinan 250100

10. P. R. China

11. College of Chemical and Environmental Engineering

12. Shandong University of Science and Technology

13. Qingdao

Abstract

The influence of isolated and penta-hydrated Zn²⁺ on some of the intramolecular proton-transfer processes of thymine is investigated by DFT modeling.

Funder

National Natural Science Foundation of China

Publisher

Royal Society of Chemistry (RSC)

Subject

General Chemical Engineering,General Chemistry

Link

http://pubs.rsc.org/en/content/articlepdf/2018/RA/C7RA13750H

Reference44 articles.

1. Double-Proton Transfer in Adenine−Thymine and Guanine−Cytosine Base Pairs. A Post-Hartree−Fock ab Initio Study

2. Refinement of labile hydrogen positions based on DFT calculations of 1H NMR chemical shifts: comparison with X-ray and neutron diffraction methods

3. Correlated ab initio study of nucleic acid bases and their tautomers in the gas phase, in a microhydrated environment and in aqueous solution. Part 4. Uracil and thymine

4. Tautomers of cytosine by microwave spectroscopy

5. An experimental and quantum chemical study on the non-covalent interactions of a cyclometallated Rh(iii) complex with DNA and BSA

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1. Do the fragments from decomposed ZIF-8 greatly affect some of the intramolecular proton-transfer of thymine? A quantum chemical study;RSC Advances;2018

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