About: Voityuk Alexander A.

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Attributs	Valeurs
type	Person
name	Voityuk Alexander A.
familyName	Voityuk
Given name	A. A. Alexander A.
is relates of	http://hub.abes.fr/acs/periodical/jpcbfk/2006/volume_110/issue_42/101021jp062776d/authorship/1 http://hub.abes.fr/acs/periodical/jpcbfk/2008/volume_112/issue_3/101021jp076405o/authorship/8 http://hub.abes.fr/acs/periodical/jpccck/2007/volume_111/issue_19/101021jp070228/authorship/1 http://hub.abes.fr/acs/periodical/jacsat/1997/volume_119/issue_13/101021ja963901/authorship/1 http://hub.abes.fr/acs/periodical/jpcafh/2002/volume_106/issue_33/101021jp014232b/authorship/3 http://hub.abes.fr/acs/periodical/jpcbfk/2008/volume_112/issue_27/101021jp802222e/authorship/2 http://hub.abes.fr/acs/periodical/jpcbfk/2005/volume_109/issue_21/101021jp050985c/authorship/1 http://hub.abes.fr/acs/periodical/jpcbfk/2002/volume_106/issue_11/101021jp013417f/authorship/1 http://hub.abes.fr/acs/periodical/jpcbfk/2002/volume_106/issue_32/101021jp014261m/authorship/2 http://hub.abes.fr/acs/periodical/jpcbfk/2005/volume_109/issue_38/101021jp052783m/authorship/1 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is Author of	Use of the eigenvalues of the matrix of the resonance interaction of the orbitals for an analysis of the M-lig bonds in the complexes cis- and trans-[Pd(NH3)2Cl2] Parameters For Excess Electron Transfer in DNA. Estimation Using Unoccupied Kohn−Sham Orbitals and TD DFT The Effect of Pyrimidine Bases on the Hole-Transfer Coupling in DNA† A Quantum Chemical Study of Photoinduced DNA Repair: Onthe Splitting of Pyrimidine Model Dimers Initiated by ElectronTransfer Superexchange Mediated Charge Hopping in DNA Chromophore/DNA Interactions: Femto- to Nanosecond Spectroscopy, NMR Structure, andElectron Transfer Theory Electronic Coupling Mediated by Stacked [Thymine-Hg-Thymine] Base Pairs MS-CASPT2 Calculation of Excess Electron Transfer in Stacked DNA Nucleobases Prediction of Alternative Structures of theMolybdenum Site in the Xanthine Oxidase-RelatedAldehyde Oxido Reductase Quantum Chemical Modeling of Electron Hole Transfer through π Stacks of Normal andModified Pairs of Nucleobases An x-ray spectral and quantum-chemical study of the electronic structure of ruthenium complexes CASSCF/CAS-PT2 Study of Hole Transfer in Stacked DNA Nucleobases Estimate of the Reorganization Energy for Charge Transfer in DNA One-center parameters dependent on the valence state of the atom. III. Transition elements of periods IV and V Use of X-ray spectra to determine the semiempirical parameters of 4d transition metals A program for searching for semiempirical parameters by the MNDO method Stereoelectronic effect in reactions of phosphoester bond rupture Electronic Couplings in DNA π-Stacks: Multistate Effects How to Switch the Direction of Photoinduced Charge Injection into DNA? Hole Transfer Energetics in Structurally Distorted DNA: The Nucleosome Core Particle π Stack Structure and Hole Transfer Couplings in DNA Hairpins and DNA. A Combined QM/MD Study Buckycatcher. A New Opportunity for Charge-Transfer Mediation? Study of rotational isomerism in thiophenol, thioanisole, and their polyfluorinated derivatives Parameters of MNDO method for Zn atom Quantum chemical study of molecular ion complexes with hydrogen bonds (Review) Program for calculating the electronic structure of molecules, complexes, and clusters in the INDO aproximation Extension of the MNDO formalism tod orbitals: Integral approximations and preliminary numerical results MNDO parameters for the Ca atom Quantum-chemical study of the mechanism of the hydrolysis of amides in the gas phase and in aqueous solution An indo study of the electronic structure of the planar complexes [Pd(NH3)nCl4−n]n−2 X-ray spectra and electronic structure of the PCl3 molecule Revised semiempirical parameters for Br, I, Sn, Hg, and Pb in the MNDO method Quantum-chemical study of the effect of solvation on the strength of the phosphamide bond in N-phosphorylammonium cations and zwitterions Diazabicycloalkanes with nitrogen atoms in bridgehead positions. MNDO calculations of systems with hydrogen bonds S-H One-center parameters dependent on the valence state of the atom Change in the electronic structure of the thiocyanate ion on coordination Investigation of electronic structure of chloro complexes of Rhodium(III) MNDO calculations on systems containing S-H hydrogen bonds Structure and energy characteristic of [Mg(H3O)n]2+ and [Mg(H2O)n−1OH]+ complexes according to data from MNDO calculations Electronic structure of anions of organic dithioacids and their oxidation-reduction and electron-donor properties

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