E. O. Voronkov

Novel physically adapted STO^##‐3G basis sets. Efficiency for prediction of second‐order electric and magnetic properties of aromatic hydrocarbons

E. O. Voronkov, V. V. Rossikhin, Sergiy I. Okovytyy et al. · International Journal of Quantum Chemistry · 2011 · 25 citations

Natural Sciences, Chemistry, Physics +14

Origin of Substituent Effect on Tautomeric Behavior of 1,2,4-Triazole Derivatives: Combined Spectroscopic and Theoretical Study

Tetiana Sergeieva, Maria Bilichenko, Sergiy Holodnyak et al. · The Journal of Physical Chemistry A · 2016 · 19 citations

Natural Sciences, Chemistry, Medicinal Chemistry +13

An Investigation of the¹⁷O NMR Chemical Shifts in Oxiranes Using Magnetically Corrected Basis Sets

V. V. Rossikhin, Sergiy I. Okovytyy, Lilija I. Kasyan et al. · The Journal of Physical Chemistry A · 2002 · 15 citations

Natural Sciences, Chemistry, Computational Chemistry +4

The performance of the new 6‐31G^## basis set: Molecular structures and vibrational frequencies of transition metal carbonyls

V. I. Bolshakov, V. V. Rossikhin, E. O. Voronkov et al. · Journal of Computational Chemistry · 2007 · 13 citations

Natural Sciences, Chemistry, Physics +17

QSPR modeling of optical rotation of amino acids using specific quantum chemical descriptors

Natalia Sizochenko, Sedat Karabulut, Sergiy I. Okovytyy et al. · Journal of Molecular Modeling · 2018 · 12 citations

Natural Sciences, Chemistry, Medicinal Chemistry +17