Vladimir Potemkin
Vladimir Potemkin
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Online chemical modeling environment (OCHEM): web platform for data storage, model development and publishing of chemical information
I Sushko, S Novotarskyi, R Körner, AK Pandey, M Rupp, W Teetz, ...
Journal of computer-aided molecular design 25 (6), 533-554, 2011
2872011
ToxAlerts: a web server of structural alerts for toxic chemicals and compounds with potential adverse reactions
I Sushko, E Salmina, VA Potemkin, G Poda, IV Tetko
Journal of chemical information and modeling 52 (8), 2310-2316, 2012
1312012
Atoms-in-molecules study of intra-and intermolecular bonding in the pentaerythritol tetranitrate crystal
EA Zhurova, AI Stash, VG Tsirelson, VV Zhurov, EV Bartashevich, ...
Journal of the American Chemical Society 128 (45), 14728-14734, 2006
1192006
Principles for 3D/4D QSAR classification of drugs
V Potemkin, M Grishina
Drug discovery today 13 (21-22), 952-959, 2008
552008
Determination of covalent bond orders and atomic valence indices using topological features of the experimental electron density
VG Tsirelson, EV Bartashevich, AI Stash, VA Potemkin
Acta Crystallographica Section B: Structural Science 63 (1), 142-150, 2007
552007
A new paradigm for pattern recognition of drugs
VA Potemkin, MA Grishina
Journal of Computer-aided Molecular Design 22 (6-7), 489-505, 2008
532008
Molecular and crystal properties of ethyl 4, 6-dimethyl-2-thioxo-1, 2, 3, 4-tetrahydropyrimidine-5-carboxylate from experimental and theoretical electron densities
VG Tsirelson, AI Stash, VA Potemkin, AA Rykounov, AD Shutalev, ...
Acta Crystallographica Section B: Structural Science 62 (4), 676-688, 2006
472006
Technique for energy decomposition in the study of “receptor-ligand” complexes
VA Potemkin, AA Pogrebnoy, MA Grishina
Journal of chemical information and modeling 49 (6), 1389-1406, 2009
462009
Autowave processes of forming gels as a cause of the coloring of oxyhydrate gels (the chromatic effect) of some rare earth metals (yttrium, gadolinium)
YI Sukharev, VA Potemkin, BA Markov
Colloids and Surfaces A: Physicochemical and Engineering Aspects 194 (1-3 …, 2001
402001
A Method for Multiconformational Modeling of the Three‐Dimensional Shape of a Molecule
EV Bartashevich, VA Potemkin, MA Grishina, AV Belik
Journal of Structural Chemistry 43 (6), 1033-1039, 2002
322002
Compressibility of gas hydrates
AY Manakov, AY Likhacheva, VA Potemkin, AG Ogienko, AV Kurnosov, ...
ChemPhysChem 12 (13), 2476-2484, 2011
312011
Kinetic resolution of (±)-2, 3-dihydro-3-methyl-4H-1, 4-benzoxazine in the reaction with (S)-naproxen chloride: a theoretical study
VA Potemkin, VP Krasnov, GL Levit, EV Bartashevich, IN Andreeva, ...
Mendeleev Communications 14 (2), 69-71, 2004
262004
[4+ 2]-Cycloaddition of 3, 6-bis (3, 5-dimethyl-4-R-pyrazol-1-yl)-1, 2, 4, 5-tetrazines with alkenes
GL Rusinov, RI Ishmetova, NI Latosh, IN Ganebnych, ON Chupakhin, ...
Russian Chemical Bulletin 49 (2), 355-362, 2000
252000
Mutations in fd phage major coat protein modulate affinity of the displayed peptide
GA Kuzmicheva, PK Jayanna, AM Eroshkin, MA Grishina, ...
Protein Engineering, Design & Selection 22 (10), 631-639, 2009
232009
3D QSAR analysis and pharmacophore modelling of p38 MAP kinase inhibitors using BiS algorithm
K Mikuchina, V Potemkin, M Grishina, S Laufer
Arch. Pharm. Pharm. Med. Chem 335 (1), C74, 2002
232002
A new approach to predicting the thermodynamic parameters of substances from molecular characteristics
VA Potemkin, EV Bartashevich, AV Belik
Russian Journal of Physical Chemistry A 70 (3), 411-415, 1996
231996
Theoretical investigation of the antituberculous activity of membranotropic podands
VA Potemkin, MA Grishina, OV Fedorova, GL Rusinov, IG Ovchinnikova, ...
Pharmaceutical Chemistry Journal 37 (9), 468-472, 2003
212003
Genetic algorithm for predicting structures and properties of molecular aggregates in organic substances
MA Grishina, EV Bartashevich, VA Potemkin, AV Belik
Journal of Structural Chemistry 43 (6), 1040-1044, 2002
212002
Multiconformational method for analyzing the biological activity of molecular structures
VA Potemkin, RM Arslambekov, EV Bartashevich, MA Grishina, AV Belik, ...
Journal of Structural Chemistry 43 (6), 1045-1049, 2002
212002
A model for calculating the atomic volumetric characteristics in molecular systems
VA Potemkin, EV Bartashevich, AV Belik
Russian Journal of Physical Chemistry A 72 (4), 561-566, 1998
211998
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