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Conformational diversity of the quercetin molecule: A quantum-chemical viewBrovarets’, Ol’ha O.; Hovorun, Dmytro M. · Journal of Biomolecular Structure and Dynamics · 2019
Can DNA-binding proteins of replisome tautomerize nucleotide bases? <i>Ab initio</i> model studyBrovarets’, Ol’ha O.; Yurenko, Yevgen P.; Dubey, Igor Ya.; Hovorun, Dmytro M. · 2012
Surprising Conformers of the Biologically Important A·T DNA Base Pairs: QM/QTAIM ProofsBrovarets', Ol'ha O.; Tsiupa, Kostiantyn S.; Hovorun, Dmytro M. · Frontiers in Chemistry · 2018
Key microstructural mechanisms of the 2-aminopurine mutagenicity: Results of extensive quantum-chemical researchBrovarets’, Ol’ha O.; Hovorun, Dmytro M. · Journal of Biomolecular Structure and Dynamics · 2018
Prototropic tautomerism and basic molecular principles of hypoxanthine mutagenicity: an exhaustive quantum-chemical analysisBrovarets’, Ol’ha O.; Hovorun, Dmytro M. · Journal of Biomolecular Structure and Dynamics · 2013
Proton tunneling in the A∙T Watson-Crick DNA base pair: myth or reality?Brovarets’, Ol’ha O.; Hovorun, Dmytro M. · Journal of Biomolecular Structure and Dynamics · 2015
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
Unintentional doping in GaNZhu, Tongtong; Oliver, Rachel A. · Physical Chemistry Chemical Physics · 2012
Self-healing superhydrophobic materialsIonov, Leonid; Synytska, Alla · Physical Chemistry Chemical Physics · 2012
Redox reduxBeratan, David N.; Onuchic, José N. · Physical Chemistry Chemical Physics · 2012
Miniature biofuel cellsHeller, Adam · Physical Chemistry Chemical Physics · 2004
The hydrophobic effectWidom, B.; Bhimalapuram, P.; Koga, Kenichiro · Physical Chemistry Chemical Physics · 2003
Inelastic transport: a pseudoparticle approachWhite, Alexander J.; Galperin, Michael · Physical Chemistry Chemical Physics · 2012
Quantum chemistry of macromolecules and solidsHirata, So · Physical Chemistry Chemical Physics · 2009
Molecular controlled nano-devicesNaaman, Ron · Physical Chemistry Chemical Physics · 2011