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ResearcherID: Q-6008-2016
Scopus Author ID: 7005260783

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South Ural State University: Chelyabinsk, RU

Head of Laboratory (Laboratory of Computational Modeling of Drugs)
Employment
Source: Self-asserted source
Vladimir Potemkin

Works (50 of 79)

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Page 1 of 2

The Complementarity Principle—One More Step towards Analytical Docking on the Example of Dihydrofolate Reductase Complexes

Life
2021-09 | Journal article | Author
DOI: 10.3390/life11090983
Contributors: Vladimir Potemkin; Maria Grishina
Source: check_circle
Multidisciplinary Digital Publishing Institute

Electron Density Analysis of SARS-CoV-2 RNA-Dependent RNA Polymerase Complexes

Molecules
2021-06 | Journal article | Author
DOI: 10.3390/molecules26133960
Contributors: Nadezhda Palko; Maria Grishina; Vladimir Potemkin
Source: check_circle
Multidisciplinary Digital Publishing Institute

Theoretical investigation of electron structure and surface morphology of titanium dioxide anatase nano-particles

Computational and Theoretical Chemistry
2016 | Journal article
DOI: 10.1016/j.comptc.2016.07.003
EID:

2-s2.0-84978954642
Contributors: Grishina, M.; Bolshakov, O.; Potemkin, A.; Potemkin, V.
Source: Self-asserted source
Vladimir Potemkin via Scopus - Elsevier

Variation in predicted internal concentrations in relation to PBPK model complexity for rainbow trout

Science of the Total Environment
2016 | Journal article
DOI: 10.1016/j.scitotenv.2016.01.107
EID:

2-s2.0-84956681869
Contributors: Salmina, E.S.; Wondrousch, D.; Kühne, R.; Potemkin, V.A.; Schüürmann, G.
Source: Self-asserted source
Vladimir Potemkin via Scopus - Elsevier

Design and theoretical study of D-A- π -A organic sensitizers with [1,2,5]Thiadiazolo[3,4- c ]pyridine, [1,2,5]Selenadiazolo[3,4- c ]pyridine, and [1,2,5]Oxadiazolo[3,4- c ]pyridine π Component

Journal of Chemistry
2015 | Journal article
DOI: 10.1155/2015/467593
EID:

2-s2.0-84957083574
Contributors: Bolshakov, O.I.; Grishina, M.A.; Galushko, A.; Potemkin, V.A.; Rakitin, O.A.
Source: Self-asserted source
Vladimir Potemkin via Scopus - Elsevier

An approximation of the Cioslowski-Mixon bond order indexes using the AlteQ approach

Journal of Computer-Aided Molecular Design
2013 | Journal article
DOI: 10.1007/s10822-013-9677-z
EID:

2-s2.0-84887104736
Contributors: Salmina, E.; Grishina, M.A.; Potemkin, V.A.
Source: Self-asserted source
Vladimir Potemkin via Scopus - Elsevier

Crystal and electronic structure of heteromolecular complexes of 3,6-bis(3,5-dymethylpyrazole-1-yl)-1,2,4,5-tetrazine with azoles

Journal of Structural Chemistry
2013 | Journal article
DOI: 10.1134/S0022476613060139
EID:

2-s2.0-84898622245
Contributors: Slepukhin, P.A.; Salmina, E.S.; Potemkin, V.A.; Grishina, M.A.
Source: Self-asserted source
Vladimir Potemkin via Scopus - Elsevier

Effect of the structural characteristics of dihydrofolate reductase inhibitors on their metabolic properties

Journal of Structural Chemistry
2012 | Journal article
DOI: 10.1134/S0022476612020230
EID:

2-s2.0-84863697710
Contributors: Afon'kina, E.S.; Pal'Ko, N.N.; Matveev, G.A.; Toreeva, N.A.; Potemkin, V.A.; Grishina, M.A.
Source: Self-asserted source
Vladimir Potemkin via Scopus - Elsevier

ToxAlerts: A web server of structural alerts for toxic chemicals and compounds with potential adverse reactions

Journal of Chemical Information and Modeling
2012 | Journal article
DOI: 10.1021/ci300245q
EID:

2-s2.0-84865485155
Contributors: Sushko, I.; Salmina, E.; Potemkin, V.A.; Poda, G.; Tetko, I.V.
Source: Self-asserted source
Vladimir Potemkin via Scopus - Elsevier

Compressibility of gas hydrates

ChemPhysChem
2011 | Journal article
DOI: 10.1002/cphc.201100126
EID:

2-s2.0-80052461743
Contributors: Manakov, A.Y.; Likhacheva, A.Y.; Potemkin, V.A.; Ogienko, A.G.; Kurnosov, A.V.; Ancharov, A.I.
Source: Self-asserted source
Vladimir Potemkin via Scopus - Elsevier

Intermolecular interactions in heteromolecular crystals of tetrazine derivatives with azoles

Journal of Structural Chemistry
2011 | Journal article
DOI: 10.1134/S0022476611060187
EID:

2-s2.0-84867442591
Contributors: Salmina, E.S.; Rusinov, G.L.; Slepukhin, P.A.; Ishmetova, R.I.; Tolshchina, S.G.; Potemkin, V.A.; Grishina, M.A.
Source: Self-asserted source
Vladimir Potemkin via Scopus - Elsevier

Online chemical modeling environment (OCHEM): Web platform for data storage, model development and publishing of chemical information

Journal of Computer-Aided Molecular Design
2011 | Journal article
DOI: 10.1007/s10822-011-9440-2
EID:

2-s2.0-80051551297
Contributors: Sushko, I.; Novotarskyi, S.; Körner, R.; Pandey, A.K.; Rupp, M.; Teetz, W.; Brandmaier, S.; Abdelaziz, A.; Prokopenko, V.V.; Tanchuk, V.Y. et al.
Source: Self-asserted source
Vladimir Potemkin via Scopus - Elsevier

Changes in the vibrational characteristics of substituted 1,2,4,5-tetrazines after complexation with 1,2,3-benzotriazole: A theoretical study

Journal of Structural Chemistry
2010 | Journal article
DOI: 10.1007/s10947-009-0155-3
EID:

2-s2.0-77949613028
Contributors: Ivshina, N.N.; Bartashevich, E.V.; Potemkin, V.A.; Grishina, M.A.; Ishmetova, R.I.; Rusinov, G.L.; Latosh, N.I.; Slepukhin, P.A.; Charushin, V.N.
Source: Self-asserted source
Vladimir Potemkin via Scopus - Elsevier

Modeling complexes of substrates with cytochrome P450 2C9

Pharmaceutical Chemistry Journal
2010 | Journal article
DOI: 10.1007/s11094-010-0438-1
EID:

2-s2.0-78149414205
Contributors: Pogrebnoi, A.A.; Grishina, M.A.; Potemkin, V.A.; Sysakov, D.A.
Source: Self-asserted source
Vladimir Potemkin via Scopus - Elsevier

Modeling of complexes between cytochrome P450 1A2 and substrates

Journal of Structural Chemistry
2010 | Journal article
DOI: 10.1007/s10947-009-0122-z
EID:

2-s2.0-75649114158
Contributors: Pogrebnoy, A.A.; Grishina, M.A.; Potemkin, V.A.
Source: Self-asserted source
Vladimir Potemkin via Scopus - Elsevier

The theoretical study of interaction of unsymmetrical 3,6-substituted symtetrazines with some enamines

Khimiya Geterotsiklicheskikh Soedinenii
2010 | Journal article
EID:

2-s2.0-77957604049
Contributors: Afonkina, E.S.; Potemkin, V.A.; Grishina, M.A.
Source: Self-asserted source
Vladimir Potemkin via Scopus - Elsevier

Theoretical investigation of the reaction of unsymmetrical 3,6-disubstituted sym-tetrazines with certain enamines

Chemistry of Heterocyclic Compounds
2010 | Journal article
DOI: 10.1007/s10593-010-0611-1
EID:

2-s2.0-78650883334
Contributors: Afonkina, E.S.; Potemkin, V.A.; Grishina, M.A.
Source: Self-asserted source
Vladimir Potemkin via Scopus - Elsevier

Theoretical studies of the electronic and structural features of the fragments of dihydropholate reductase inhibitors

Journal of Structural Chemistry
2010 | Journal article
DOI: 10.1007/s10947-009-0146-4
EID:

2-s2.0-75649141559
Contributors: Afonkina, E.S.; Pereyaslavskaya, E.S.; Potemkin, V.A.; Grishina, M.A.; Rusinov, G.L.; Fedorova, O.V.
Source: Self-asserted source
Vladimir Potemkin via Scopus - Elsevier

Mutations in fd phage major coat protein modulate affinity of the displayed peptide

Protein Engineering, Design and Selection
2009 | Journal article
DOI: 10.1093/protein/gzp043
EID:

2-s2.0-78649921945
Contributors: Kuzmicheva, G.A.; Jayanna, P.K.; Eroshkin, A.M.; Grishina, M.A.; Pereyaslavskaya, E.S.; Potemkin, V.A.; Petrenko, V.A.
Source: Self-asserted source
Vladimir Potemkin via Scopus - Elsevier

Technique for energy decomposition in the study of "receptor- ligand" complexes

Journal of Chemical Information and Modeling
2009 | Journal article
DOI: 10.1021/ci800405n
EID:

2-s2.0-67650077389
Contributors: Potemkin, V.A.; Pogrebnoy, A.A.; Grishina, M.A.
Source: Self-asserted source
Vladimir Potemkin via Scopus - Elsevier

Theoretical study of the conformational features of triosmium clusters

Journal of Structural Chemistry
2009 | Journal article
DOI: 10.1007/s10947-009-0202-0
EID:

2-s2.0-77949790009
Contributors: Potemkin, V.A.; Ivshina, N.N.; Maksakov, V.A.
Source: Self-asserted source
Vladimir Potemkin via Scopus - Elsevier

A new paradigm for pattern recognition of drugs

Journal of Computer-Aided Molecular Design
2008 | Journal article
DOI: 10.1007/s10822-008-9203-x
EID:

2-s2.0-44249118053
Contributors: Potemkin, V.A.; Grishina, M.A.
Source: Self-asserted source
Vladimir Potemkin via Scopus - Elsevier

A study of conformational states of substrates of cytochrome P450 3A4

Biofizika
2008 | Journal article
EID:

2-s2.0-56149104720
Contributors: Grishina, M.A.; Potemkin, V.A.; Pogrebnoǐ, A.A.; Ivshina, N.N.
Source: Self-asserted source
Vladimir Potemkin via Scopus - Elsevier

A study of conformational states of substrates of isoform 3A4 of cytochrome P450

Biophysics
2008 | Journal article
DOI: 10.1134/S0006350908050060
EID:

2-s2.0-59849120591
Contributors: Grishina, M.A.; Potemkin, V.A.; Pogrebnoi, A.A.; Ivshina, N.N.
Source: Self-asserted source
Vladimir Potemkin via Scopus - Elsevier

Modulating affinity of landscape phage nanoparticles by mutagenesis of the major coat protein

Technical Proceedings of the 2008 NSTI Nanotechnology Conference and Trade Show, NSTI-Nanotech, Nanotechnology 2008
2008 | Conference paper
EID:

2-s2.0-52649089654
Contributors: Kuzmicheva, G.A.; Eroshkin, A.M.; Potemkin, V.A.; Jayannaand, P.K.; Petrenko, V.A.
Source: Self-asserted source
Vladimir Potemkin via Scopus - Elsevier

Principles for 3D/4D QSAR classification of drugs

Drug Discovery Today
2008 | Journal article
DOI: 10.1016/j.drudis.2008.07.006
EID:

2-s2.0-54049156024
Contributors: Potemkin, V.; Grishina, M.
Source: Self-asserted source
Vladimir Potemkin via Scopus - Elsevier

Theoretical investigation of the antituberculosis activity of compounds of the dihydropyrimidine series

Pharmaceutical Chemistry Journal
2008 | Journal article
DOI: 10.1007/s11094-009-0198-y
EID:

2-s2.0-64449084611
Contributors: Pereyaslavskaya, E.S.; Potemkin, V.A.; Bartashevich, E.V.; Grishina, M.A.; Rusinov, G.L.; Fedorova, O.V.; Zhidovinova, M.S.; Ovchinnikova, I.G.
Source: Self-asserted source
Vladimir Potemkin via Scopus - Elsevier

Theoretical study of acridane oxidation reactions

Journal of Structural Chemistry
2008 | Journal article
DOI: 10.1007/s10947-008-0002-y
EID:

2-s2.0-43049106456
Contributors: Grishina, M.A.; Potemkin, V.A.; Matern, A.I.
Source: Self-asserted source
Vladimir Potemkin via Scopus - Elsevier

X-ray and conformation analysis of the new trinuclear cluster of osmium Os3(μ,η2-OCC6H5) (η3-C3H5)(CO)9

Journal of Structural Chemistry
2008 | Journal article
DOI: 10.1007/s10947-008-0154-9
EID:

2-s2.0-56449117863
Contributors: Maksakov, V.A.; Pervukhina, N.V.; Podberezskaya, N.V.; Afonin, M.Yu.; Potemkin, V.A.; Kirin, V.P.
Source: Self-asserted source
Vladimir Potemkin via Scopus - Elsevier

X-ray and quantum-topological studies of intermolecular interactions in partially fluorinated quinoline crystals

Journal of Structural Chemistry
2008 | Journal article
DOI: 10.1007/s10947-008-0155-8
EID:

2-s2.0-56449118342
Contributors: Bagryanskaya, I.Yu.; Grishina, M.A.; Safina, L.Yu.; Selivanova, G.A.; Potemkin, V.A.; Gatilov, Yu.V.
Source: Self-asserted source
Vladimir Potemkin via Scopus - Elsevier

Determination of covalent bond orders and atomic valence indices using topological features of the experimental electron density

Acta Crystallographica Section B: Structural Science
2007 | Journal article
DOI: 10.1107/S0108768106046003
EID:

2-s2.0-33846546543
Contributors: Tsirelson, V.G.; Bartashevich, E.V.; Stash, A.I.; Potemkin, V.A.
Source: Self-asserted source
Vladimir Potemkin via Scopus - Elsevier

Geometric isomerism in the series of fluoroalkyl-containing 1,2,3-trione 2-arylhydrazones

Russian Journal of Organic Chemistry
2007 | Journal article
DOI: 10.1134/S1070428007030086
EID:

2-s2.0-34247342522
Contributors: Khudina, O.G.; Shchegol'Kov, E.V.; Burgart, Ya.V.; Kodess, M.I.; Saloutin, V.I.; Kazheva, O.N.; Shilov, G.V.; D'Yachenko, O.A.; Grishina, M.A.; Potemkin, V.A. et al.
Source: Self-asserted source
Vladimir Potemkin via Scopus - Elsevier

Modeling of drug molecule orientation within a receptor cavity in the BiS algorithm framework

Journal of Structural Chemistry
2007 | Journal article
DOI: 10.1007/s10947-007-0023-y
EID:

2-s2.0-34249050236
Contributors: Potemkin, V.A.; Grishina, M.A.; Bartashevich, E.V.
Source: Self-asserted source
Vladimir Potemkin via Scopus - Elsevier

Quantum-topological analysis of electron density in azachalcogenene crystals with aromatic substituents

Journal of Structural Chemistry
2007 | Journal article
DOI: 10.1007/s10947-007-0116-7
EID:

2-s2.0-35649021746
Contributors: Bartashevich, E.V.; Potemkin, V.A.; Bagryanskaya, I.Yu.
Source: Self-asserted source
Vladimir Potemkin via Scopus - Elsevier

Structure formation in heavy metal oxyhydrates at low rates of gel formation

Journal of Structural Chemistry
2007 | Journal article
DOI: 10.1007/s10947-007-0114-9
EID:

2-s2.0-35648962379
Contributors: Avdin, V.V.; Lymar, A.A.; Batist, A.V.; Nikitin, E.A.; Belkanova, M.Yu.; Potemkin, V.A.
Source: Self-asserted source
Vladimir Potemkin via Scopus - Elsevier

Synthesis, structure, and complexing ability of fluoroalkyl-containing 2,2′-(biphenyl-4,4′-diyldihydrazono)bis(1,3-dicarbonyl) compounds

Russian Journal of Organic Chemistry
2007 | Journal article
DOI: 10.1134/S107042800712007X
EID:

2-s2.0-60449089303
Contributors: Shchur, I.V.; Khudina, O.G.; Burgart, Ya.V.; Saloutin, V.I.; Grishina, M.A.; Potemkin, V.A.
Source: Self-asserted source
Vladimir Potemkin via Scopus - Elsevier

Theoretical study of the conformational states of triosmium clusters with a chiral μ-1-NH pinane ligand

Journal of Structural Chemistry
2007 | Journal article
DOI: 10.1007/s10947-007-0036-6
EID:

2-s2.0-34547507323
Contributors: Potemkin, V.A.; Maksakov, V.A.; Korenev, V.S.
Source: Self-asserted source
Vladimir Potemkin via Scopus - Elsevier

Triosmium cluster with the bridging aminooxime derivative of pinane: Synthesis, crystal structure and conformational analysis

Russian Journal of Coordination Chemistry/Koordinatsionnaya Khimiya
2007 | Journal article
DOI: 10.1134/S1070328407080088
EID:

2-s2.0-34548426412
Contributors: Korenev, V.S.; Kirin, V.P.; Maksakov, V.A.; Virovets, A.V.; Tkachev, S.V.; Potemkin, V.A.; Agafontsev, A.M.; Tkachev, A.V.
Source: Self-asserted source
Vladimir Potemkin via Scopus - Elsevier

A quantum topological study of the electron density in monomers and dimers of acyclic azathiens with aromatic substituents

Journal of Structural Chemistry
2006 | Journal article
DOI: 10.1007/s10947-006-0275-y
EID:

2-s2.0-33748923786
Contributors: Bartashevich, E.V.; Abdrakhmanova, M.R.; Potemkin, V.A.; Bagryanskaya, I.Yu.
Source: Self-asserted source
Vladimir Potemkin via Scopus - Elsevier

Atoms-in-molecules study of intra- and intermolecular bonding in the pentaerythritol tetranitrate crystal

Journal of the American Chemical Society
2006 | Journal article
DOI: 10.1021/ja0658620
EID:

2-s2.0-33751010192
Contributors: Zhurova, E.A.; Stash, A.I.; Tsirelson, V.G.; Zhurov, V.V.; Bartashevich, E.V.; Potemkin, V.A.; Pinkerton, A.A.
Source: Self-asserted source
Vladimir Potemkin via Scopus - Elsevier

Directions in structure formation of oxyhydrate gels of zirconium and rare earth elements

Journal of Structural Chemistry
2006 | Journal article
DOI: 10.1007/s10947-006-0280-1
EID:

2-s2.0-33748923946
Contributors: Sukharev, Yu.I.; Avdin, V.V.; Lymar, A.A.; Belkanova, M.Yu.; Potemkin, V.A.
Source: Self-asserted source
Vladimir Potemkin via Scopus - Elsevier

Modeling of 1,2,4,5-tetrazine complexes with organic amines

Journal of Structural Chemistry
2006 | Journal article
DOI: 10.1007/s10947-006-0438-x
EID:

2-s2.0-34247484000
Contributors: Grishina, M.A.; Potemkin, V.A.; Bartashevich, E.V.; Sinyaev, A.N.; Rusinov, G.L.; Latosh, N.I.; Ganebnykh, I.N.; Koryakova, O.V.; Ishmetova, R.I.
Source: Self-asserted source
Vladimir Potemkin via Scopus - Elsevier

Molecular and crystal properties of ethyl 4,6-dimethyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate from experimental and theoretical electron densities

Acta Crystallographica Section B: Structural Science
2006 | Journal article
DOI: 10.1107/S0108768106016326
EID:

2-s2.0-33746054607
Contributors: Tsirelson, V.G.; Stash, A.I.; Potemkin, V.A.; Rykounov, A.A.; Shutalev, A.D.; Zhurova, E.A.; Zhurov, V.V.; Pinkerton, A.A.; Gurskaya, G.V.; Zavodnik, V.E.
Source: Self-asserted source
Vladimir Potemkin via Scopus - Elsevier

New type of phase transformation in gas hydrate forming system at high pressures. Some experimental and computational investigations of clathrate hydrates formed in the SF<inf>6</inf>-H<inf>2</inf>O system

Journal of Physical Chemistry B
2006 | Journal article
DOI: 10.1021/jp061698r
EID:

2-s2.0-33751263500
Contributors: Aladko, E.Ya.; Ancharov, A.I.; Goryainov, S.V.; Kurnosov, A.V.; Larionov, E.G.; Likhacheva, A.Yu.; Manakov, A.Yu.; Potemkin, V.A.; Sheromov, M.A.; Teplykh, A.E. et al.
Source: Self-asserted source
Vladimir Potemkin via Scopus - Elsevier

Experimental investigation and modeling of the cathodoluminescence of 1,2,4-triazine derivatives

Journal of Applied Spectroscopy
2005 | Journal article
DOI: 10.1007/s10812-005-0126-1
EID:

2-s2.0-30544443682
Contributors: Tarkhov, L.I.; Potemkin, V.A.; Kozhevnikov, D.N.
Source: Self-asserted source
Vladimir Potemkin via Scopus - Elsevier

Modeling the interaction of human cytochrome P4502E1 with substrates

Biophysics
2005 | Journal article
EID:

2-s2.0-33750498451
Contributors: Potemkin, V.A.; Grishina, M.A.; Bartachevich, E.V.; Zrakova, T.Yu.; Pogrebnoi, A.A.
Source: Self-asserted source
Vladimir Potemkin via Scopus - Elsevier

The modeling of interactions of the CYP2E1 isoform of human cytochrome P450 with substrates

Biofizika
2005 | Journal article
EID:

2-s2.0-23844442546
Contributors: Potemkin, V.A.; Grishina, M.A.; Bartashevich, E.V.; Zrakova, T.I.; Pogrebnoǐ, A.A.
Source: Self-asserted source
Vladimir Potemkin via Scopus - Elsevier

Theoretical study of the conformational states of triosmium clusters with a chiral pinane ligand

Journal of Structural Chemistry
2005 | Journal article
DOI: 10.1007/s10947-006-0007-3
EID:

2-s2.0-33744969538
Contributors: Potemkin, V.A.; Maksakov, V.A.; Korenev, V.S.
Source: Self-asserted source
Vladimir Potemkin via Scopus - Elsevier

Theoretical study of the substrate specificity of cytochrome P-450 isoforms

Pharmaceutical Chemistry Journal
2005 | Journal article
DOI: 10.1007/s11094-006-0011-0
EID:

2-s2.0-33645072742
Contributors: Grishina, M.A.; Pogrebnoi, A.A.; Potemkin, V.A.; Zrakova, T.Yu.
Source: Self-asserted source
Vladimir Potemkin via Scopus - Elsevier

Kinetic resolution of (±)-2,3-dihydro-3-methyl-4H-1,4-benzoxazine in the reaction with (S)-naproxen chloride: A theoretical study

Mendeleev Communications
2004 | Journal article
DOI: 10.1070/MC2004v014n02ABEH001887
EID:

2-s2.0-27944483294
Contributors: Potemkin, V.A.; Krasnov, V.P.; Levit, G.L.; Bartashevich, E.V.; Andreeva, I.N.; Kuzminsky, M.B.; Anikin, N.A.; Charushin, V.N.; Chupakhin, O.N.
Source: Self-asserted source
Vladimir Potemkin via Scopus - Elsevier
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