Dmytro M Hovorun

Scopus Author ID Loop profile ORCID

Publication Activity (10 Years)

Years Active: 2017-2021
Publications (10 Years): 13

Top Topics

Density Functional Theory

Single Molecule

Electron Transfer

Top Venues

Journal of biomolecular structure & dynamics

Scientific reports

This page only lists publications with an associated author ORCID identifier.

Publications

Ol'ha O Brovarets', Alona Muradova, Dmytro M Hovorun
Novel mechanisms of the conformational transformations of the biologically important G·C nucleobase pairs in Watson-Crick, Hoogsteen and wobble configurations via the mutual rotations of the bases around the intermolecular H-bonds: a QM/QTAIM study. RSC advances 11 (41) (2021)
Leonid Gorb, Anatolii Pekh, Alexey Nyporko, Mykola Ilchenko, Anastasiia Golius, Tetiana Zubatiuk, Roman Zubatyuk, Igor Dubey, Dmytro M Hovorun, Jerzy Leszczynski
Effect of Microenvironment on the Geometrical Structure of d(A)5 d(T)5 and d(G)5 d(C)5 DNA Mini-Helixes and the Dickerson Dodecamer: A Density Functional Theory Study. The journal of physical chemistry. B 124 (42) (2020)
Ol'ha O Brovarets', Dmytro M Hovorun
Conformational diversity of the quercetin molecule: a quantum-chemical view. Journal of biomolecular structure & dynamics 38 (10) (2019)
Ol'ha O Brovarets', Dmytro M Hovorun
A new era of the prototropic tautomerism of the quercetin molecule: A QM/QTAIM computational advances. Journal of biomolecular structure & dynamics 38 (16) (2019)
Ol'ha O Brovarets', Dmytro M Hovorun
Key microstructural mechanisms of the 2-aminopurine mutagenicity: Results of extensive quantum-chemical research. Journal of biomolecular structure & dynamics 37 (10) (2019)
Ol'ha O Brovarets', Dmytro M Hovorun
Conformational transitions of the quercetin molecule via the rotations of its rings: a comprehensive theoretical study. Journal of biomolecular structure & dynamics 38 (10) (2019)
Ol'ha O Brovarets', Dmytro M Hovorun
Intramolecular tautomerization of the quercetin molecule due to the proton transfer: QM computational study. PloS one 14 (11) (2019)
Margarita I Zarudnaya, Iryna M Kolomiets, Andriy L Potyahaylo, Dmytro M Hovorun
Structural transitions in poly(A), poly(C), poly(U), and poly(G) and their possible biological roles. Journal of biomolecular structure & dynamics 37 (11) (2018)
Ol'ha O Brovarets', Kostiantyn S Tsiupa, Dmytro M Hovorun
The A·T(rWC)/A·T(H)/A·T(rH) ↔ A·T*(rw WC )/A·T*(w H )/A·T*(rw H ) mutagenic tautomerization via sequential proton transfer: a QM/QTAIM study. RSC advances 8 (24) (2018)
Ol'ha O Brovarets', Kostiantyn S Tsiupa, Dmytro M Hovorun
Non-dissociative structural transitions of the Watson-Crick and reverse Watson-Crick А·Т DNA base pairs into the Hoogsteen and reverse Hoogsteen forms. Scientific reports 8 (1) (2018)
Ol'ha O Brovarets', Kostiantyn S Tsiupa, Dmytro M Hovorun
Novel pathway for mutagenic tautomerization of classical А∙Т DNA base pairs via sequential proton transfer through quasi-orthogonal transition states: A QM/QTAIM investigation. PloS one 13 (6) (2018)
Ol'ha O Brovarets', Dmytro M Hovorun
Atomistic mechanisms of the double proton transfer in the H-bonded nucleobase pairs: QM/QTAIM computational lessons. Journal of biomolecular structure & dynamics 37 (7) (2018)
Ol'ha O Brovarets', Ivan S Voiteshenko, Horacio Pérez Sánchez, Dmytro M Hovorun
A QM/QTAIM detailed look at the Watson-Crick↔wobble tautomeric transformations of the 2-aminopurine·pyrimidine mispairs. Journal of biomolecular structure & dynamics 36 (7) (2017)