Vasyl Kovalishyn \ Ковалішин Василь Володимирович

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Larysa Metelytsia (Метелиця Лариса...V.P. Kukhar Institute of Bioorganic Chemistry and Petroсhemistry, NAS of Ukraine, PhD, Head of dep.Verified email at bpci.kiev.ua
Diana Hodyna (Година Діана Микола...V.P. Kukhar Institute of Bioorganic Chemistry and Petrochemistry, NAS of UkraineVerified email at bpci.kiev.ua
Igor V. TetkoBIGCHEM GmbH & Helmholtz MunichVerified email at helmholtz-munich.de
Ivan Semenyuta (Семенюта Іван Вол...PhD, Senior Researcher, V.P. Kukhar Institute of Bioorganic Chemistry and Petroсhemistry, UkraineVerified email at bpci.kiev.ua
Fatma Kandemirlikastamonu UniversitesiVerified email at kastamonu.edu.tr
Maryna Kachaevaнауковий співробітникVerified email at bpci.kiev.ua
Sergiy RogalskyV.P. Kukhar Institute of Bioorganic Chemistry and Petrochemistry of NAS of UkraineVerified email at bpci.kiev.ua
David John LivingstoneScientific ConsultantVerified email at chemquestuk.com
Iryna KopernykResearch Associate, Wroclaw University, PolandVerified email at uwr.edu.pl
Peijnenburg WillieRIVM - Center for Safety of Substances and ProductsVerified email at rivm.nl
Filomena MartinsCentro de Química Estrutural, Dep. de Química e Bioquímica, Faculdade de Ciências, Univ. de LisboaVerified email at ciencias.ulisboa.pt
Joao Aires-de-SousaVerified email at fct.unl.pt
Suheyla OzbeyHacettepe UniversityVerified email at hacettepe.edu.tr
Maria M. TrushInstitute of Bioorganic Chemistry and Petroсhemistry, NAS of UkraineVerified email at bpci.kiev.ua
Олександр Леонідович Кобзар / А.Л....Інститут біоорганічної хімії та нафтохімії ім. В. П. КухаряНАН УкраїниVerified email at bpci.kiev.ua
Abramenko NA.N. Severtsov Institute of Ecology and EvolutionVerified email at sev-in.ru
$Vsevolod Y. Tanchuk \ Всеволод Танчук$ Vsevolod Y. Tanchuk \ Всеволод Тан...IBOPC, Інститут біоорганічної хімії та нафтохімії НАН УкраїниVerified email at bpci.kiev.ua
Vlad KholodovychHigh Performance and Research Computing, Rutgers UniversityVerified email at rutgers.edu
Ruben Elvas-LeitaoProfessor of Chemistry, Instituto Superior de Engenharia de LisboaVerified email at deq.isel.ipl.pt
Cristina VenturaISEC Lisboa - Instituto Superior de Educação e CiênciasVerified email at iseclisboa.pt

$Vasyl Kovalishyn \ Ковалішин Василь Володимирович$

Vasyl Kovalishyn \ Ковалішин Василь Володимирович

Other namesVasily Kovalishyn, Vasily Kovalishin, VV Kovalishin

V.P. Kukhar Institute of Bioorganic Chemistry and Petroсhemistry, NAS of Ukraine, PhD, Senior

Verified email at bpci.kiev.ua

Artificial Intelligence QSAR Cheminformatics Drug Design ADME/T


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Synthesis and structure–antituberculosis activity relationship of 1H-indole-2, 3-dione derivatives N Karalı, A Gürsoy, F Kandemirli, N Shvets, FB Kaynak, S Özbey, ... Bioorganic & medicinal chemistry 15 (17), 5888-5904, 2007	300	2007
Design, synthesis and biological evaluation of novel isoniazid derivatives with potent antitubercular activity F Martins, S Santos, C Ventura, R Elvas-Leitão, L Santos, S Vitorino, ... European journal of medicinal chemistry 81, 119-138, 2014	133	2014
Applicability domain for in silico models to achieve accuracy of experimental measurements I Sushko, S Novotarskyi, R Körner, AK Pandey, VV Kovalishyn, ... Journal of chemometrics 24 (3‐4), 202-208, 2010	116	2010
Neural network studies. 3. Variable selection in the cascade-correlation learning architecture VV Kovalishyn, IV Tetko, AI Luik, VV Kholodovych, AEP Villa, ... Journal of Chemical Information and Computer Sciences 38 (4), 651-659, 1998	103	1998
Volume learning algorithm artificial neural networks for 3D QSAR studies IV Tetko, VV Kovalishyn, DJ Livingstone Journal of Medicinal Chemistry 44 (15), 2411-2420, 2001	89	2001
A review of recent advances towards the development of QSAR models for toxicity assessment of ionic liquids N Abramenko, L Kustov, L Metelytsia, V Kovalishyn, I Tetko, ... Journal of hazardous materials 384, 121429, 2020	86	2020
Design, synthesis and evaluation of novel sulfonamides as potential anticancer agents MV Kachaeva, DM Hodyna, IV Semenyuta, SG Pilyo, VM Prokopenko, ... Computational Biology and Chemistry 74, 294-303, 2018	65	2018
1, 3-Oxazole derivatives as potential anticancer agents: Computer modeling and experimental study I Semenyuta, V Kovalishyn, V Tanchuk, S Pilyo, V Zyabrev, V Blagodatnyy, ... Computational biology and chemistry 65, 8-15, 2016	55	2016
Modelling the toxicity of a large set of metal and metal oxide nanoparticles using the OCHEM platform V Kovalishyn, N Abramenko, I Kopernyk, L Charochkina, L Metelytsia, ... Food and Chemical Toxicology 112, 507-517, 2018	54	2018
Antibacterial Activity of Imidazolium‐Based Ionic Liquids Investigated by QSAR Modeling and Experimental Studies D Hodyna, V Kovalishyn, S Rogalsky, V Blagodatnyi, K Petko, ... Chemical Biology & Drug Design 88 (3), 422-433, 2016	53	2016
Synthesis and structure–antibacterial activity relationship investigation of isomeric 2, 3, 5-substituted perhydropyrrolo [3, 4-d] isoxazole-4, 6-diones H Agirbas, S Guner, F Budak, S Keceli, F Kandemirli, N Shvets, ... Bioorganic & medicinal chemistry 15 (6), 2322-2333, 2007	45	2007
Development of nanostructure–activity relationships assisting the nanomaterial hazard categorization for risk assessment and regulatory decision-making G Chen, WJGM Peijnenburg, V Kovalishyn, MG Vijver RSC advances 6 (57), 52227-52235, 2016	40	2016
QSAR modeling of antitubercular activity of diverse organic compounds V Kovalishyn, J Aires-de-Sousa, C Ventura, RE Leitão, F Martins Chemometrics and Intelligent Laboratory Systems 107 (1), 69-74, 2011	38	2011
Design of (quinolin-4-ylthio) carboxylic acids as new Escherichia coli DNA gyrase B inhibitors: machine learning studies, molecular docking, synthesis and biological testing L Metelytsia, D Hodyna, I Dobrodub, I Semenyuta, M Zavhorodnii, ... Computational Biology and Chemistry 85, 107224, 2020	29	2020
The structure-antituberculosis activity relationships study in a series of 5-(4-aminophenyl)-4-substituted-2, 4-dihydro-3h-1, 2, 4-triazole-3-thione derivatives. A combined … F Kandemirli, N Shvets, S Unsalan, I Kucukguzel, S Rollas, V Kovalishyn, ... Medicinal Chemistry 2 (4), 415-422, 2006	29	2006
Imidazolium ionic liquids as effective antiseptics and disinfectants against drug resistant S. aureus: In silico and in vitro studies D Hodyna, V Kovalishyn, I Semenyuta, V Blagodatnyi, S Rogalsky, ... Computational Biology and Chemistry 73, 127-138, 2018	27	2018
Predictive QSAR modeling of phosphodiesterase 4 inhibitors V Kovalishyn, V Tanchuk, L Charochkina, I Semenuta, V Prokopenko Journal of Molecular Graphics and Modelling 32, 32-38, 2012	23	2012
Investigation of the physical and rheological properties of SBR-1712 rubber compounds by neural network approaches E Demirhan, F Kandemirli, M Kandemirli, V Kovalishyn Materials & design 28 (5), 1737-1741, 2007	23	2007
The structure-inhibitory activity relationships study in a series of cyclooxygenase-2 inhibitors: a combined electronic-topological and neural networks approach A Dimoglo, V Kovalishyn, N Shvets, V Ahsen Mini Reviews in Medicinal Chemistry 5 (10), 879-892, 2005	17	2005
Human acetylcholinesterase inhibitors: electronic-topological and neural network approaches to the structure-activity relationships study F Kandemirli, M Saraçoglu, V Kovalishyn Mini Reviews in Medicinal Chemistry 5 (5), 479-487, 2005	17	2005

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