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@article{727241,
author = {FuentesandCabrera, Miguel and Sumpter, Bobby and Sponer, Judit and Sponer, Jiri and Petit, Leon and Wells, Jack},
article_number = {4},
keywords = {molecular dynamics methods; RNA},
language = {eng},
issn = {1520-6106},
journal = {JOURNAL OF PHYSICAL CHEMISTRY B},
title = {Theoretical study on structure, stability, and electronic properties of the guanine-Zn-cytosine base pair in M-DNA},
volume = {111},
year = {2007}
}
TY - JOUR
ID - 727241
AU - Fuentes-Cabrera, Miguel - Sumpter, Bobby - Sponer, Judit - Sponer, Jiri - Petit, Leon - Wells, Jack
PY - 2007
TI - Theoretical study on structure, stability, and electronic properties of the guanine-Zn-cytosine base pair in M-DNA
JF - JOURNAL OF PHYSICAL CHEMISTRY B
VL - 111
IS - 4
SP - 870-879
EP - 870-879
SN - 15206106
KW - molecular dynamics methods
KW - RNA
N2 - M-DNA is a type of metalated DNA that forms at high pH and in the presence of Zn, Ni, and Co, with the metals placed in between each base pair, as in G-Zn-C. Experiments have found that M-DNA could be a promising candidate for a variety of nanotechnological applications, as it is speculated that the metal d-states enhance the conductivity, but controversy still clouds these findings. In this paper, we carry out a comprehensive ab initio study of eight G-Zn-C models in the gas phase to help discern the structure and electronic properties of Zn-DNA.
ER -
FUENTES-CABRERA, Miguel, Bobby SUMPTER, Judit SPONER, Jiri SPONER, Leon PETIT a Jack WELLS. Theoretical study on structure, stability, and electronic properties of the guanine-Zn-cytosine base pair in M-DNA. \textit{JOURNAL OF PHYSICAL CHEMISTRY B}. 2007, roč.~111, č.~4, s.~870-879. ISSN~1520-6106.
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