Hybrid Molecular Material Exhibiting Single-Molecule Magnet Behavior and Molecular Conductivity
- 期刊名称Inorganic Chemistry
- 作者Hiraga, Hiroki; Miyasaka, Hitoshi; Nakata, Kazuya; Kajiwara, Takashi; Takaishi, Shinya; Oshima, Yugo; Nojiri, Hiroyuki; Yamashita, Masahiro
- 卷第46卷
- 期第23期
- 印刷ISSN0020-1669
- 电子ISSN1520-510X
- 文件大小760.91KB
- 发表时间2007-11
- DOI10.1021/ic700727n
- 页码9661-9671
A QM/QTAIM microstructural analysis of the tautomerisation <i>via</i> the DPT of the hypoxanthine·adenine nucleobase pairBrovarets’, Ol'ha O.; Zhurakivsky, Roman O.; Hovorun, Dmytro M. · Molecular Physics · 2014
DPT tautomerisation of the wobble guanine·thymine DNA base mispair is not mutagenic: QM and QTAIM argumentsBrovarets’, Ol’ha O.; Zhurakivsky, Roman O.; Hovorun, Dmytro M. · Journal of Biomolecular Structure and Dynamics · 2015
Structural, energetic and tautomeric properties of the T·T∗/T∗·T DNA mismatch involving mutagenic tautomer of thymine: A QM and QTAIM insightBrovarets’, Ol’ha O.; Zhurakivsky, Roman O.; Hovorun, Dmytro M. · Chemical Physics Letters · 2014
The physico-chemical “anatomy” of the tautomerization through the DPT of the biologically important pairs of hypoxanthine with DNA bases: QM and QTAIM perspectivesBrovarets’, Ol’ha O.; Zhurakivsky, Roman O.; Hovorun, Dmytro M. · Journal of Molecular Modeling · 2013
DPT tautomerization of the long A∙A* Watson-Crick base pair formed by the amino and imino tautomers of adenine: combined QM and QTAIM investigationBrovaretsâ, Olâha O.; Zhurakivsky, Roman O.; Hovorun, Dmytro M. · Journal of Molecular Modeling · 2013
Does the tautomeric status of the adenine bases change upon the dissociation of the A*·Asyn Topal–Fresco DNA mismatch? A combined QM and QTAIM atomistic insightBrovarets', Ol'ha O.; Zhurakivsky, Roman O.; Hovorun, Dmytro M. · Physical Chemistry Chemical Physics · 2014
Is the DPT tautomerization of the long A·G Watson-Crick DNA base mispair a source of the adenine and guanine mutagenic tautomers? A QM and QTAIM response to the biologically important questionBrovarets', Ol'ha O.; Zhurakivsky, Roman O.; Hovorun, Dmytro M. · Journal of Computational Chemistry · 2014
Photoelectron imaging of CH−Goebbert, Daniel J. · Chemical Physics Letters · 2012
Local statistical interpretation for water structureSun, Qiang · Chemical Physics Letters · 2013
Bridging the macro and microBerry, R. Stephen; Smirnov, Boris M. · Chemical Physics Letters · 2013
Dielectric relaxation of 1-hydroxyadamantaneKosmowska, M.; Tarasiewicz, J.; Adamczyk, M.J. · Chemical Physics Letters · 2013
Does water drive protein folding?Maruyama, Yutaka; Harano, Yuichi · Chemical Physics Letters · 2013
Hydrazine at high pressurePravica, Michael; Bai, Ligang; Liu, Yu · Chemical Physics Letters · 2013
Editorial BoardChemical Physics Letters · 2013
ContentsChemical Physics Letters · 2012