Roman O. Zhurakivsky

Intramolecular CH…O Hydrogen Bonds in the AI and BI DNA-like Conformers of Canonical Nucleosides and their Watson-Crick Pairs. Quantum Chemical and AIM Analysis

Yevgen P. Yurenko, Roman O. Zhurakivsky, S. P. Samijlenko et al. · Journal of Biomolecular Structure and Dynamics · 2011 · 101 citations

How Many Conformers Determine the Thymidine Low-Temperature Matrix Infrared Spectrum? DFT and MP2 Quantum Chemical Study

Yevgen P. Yurenko, Roman O. Zhurakivsky, Mahmoud Ghomi et al. · The Journal of Physical Chemistry B · 2007 · 65 citations

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 question

Ol’ha O. Brovarets’, Roman O. Zhurakivsky, Dmytro М. Hovorun · Journal of Computational Chemistry · 2013 · 63 citations

Genetics, Molecular Biology, Molecular Genetics +18

Ab Initio Comprehensive Conformational Analysis of 2‘-Deoxyuridine, the Biologically Significant DNA Minor Nucleoside, and Reconstruction of Its Low-Temperature Matrix Infrared Spectrum

Yevgen P. Yurenko, Roman O. Zhurakivsky, Mahmoud Ghomi et al. · The Journal of Physical Chemistry B · 2007 · 62 citations

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 insight

Ol’ha O. Brovarets’, Roman O. Zhurakivsky, Dmytro М. Hovorun · Physical Chemistry Chemical Physics · 2013 · 60 citations

Qtaim Atomistic Insight, Combined Qm, Tautomerisation Mechanism +15