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1

Application of Computational Techniques in Pharmacy and Medicine || Quantitative Structure-Property Relationship Analysis of Drugs’ Pharmacokinetics Within the Framework of Biopharmaceutics Classification System Using Simplex Representation of Molecular Structure

Gorb, Leonid, Kuz'min, Victor, Muratov, Eugene

Year:

2014

Language:

english

File:

PDF, 1.93 MB

english, 2014

2

Hierarchic system of QSAR models (1D–4D) on the base of simplex representation of molecular structure

Victor E. Kuz’min, Anatoly G. Artemenko, Pavel G. Polischuk, Eugene N. Muratov, Alexander I. Hromov, Anatoly V. Liahovskiy, Sergey A. Andronati, Svetlana Yu. Makan

Journal:

Journal of Molecular Modeling

Year:

2005

Language:

english

File:

PDF, 595 KB

english, 2005

3

Existing and Developing Approaches for QSAR Analysis of Mixtures

Eugene N. Muratov, Ekaterina V. Varlamova, Anatoly G. Artemenko, Pavel G. Polishchuk, Victor E. Kuz'min

Journal:

Molecular Informatics

Year:

2012

Language:

english

File:

PDF, 938 KB

english, 2012

4

Interpretation of QSAR Models Based on Random Forest Methods

Victor E. Kuz'min, Pavel G. Polishchuk, Anatoly G. Artemenko, Sergey A. Andronati

Journal:

Molecular Informatics

Year:

2011

Language:

english

File:

PDF, 267 KB

english, 2011

5

Benzimidazole with Broad Spectrum of Antiviral Action

Regina Lozytska, Dmitry Chikhichin, Victror Lozitsky, Alla Fedchuk, Victor Kuz’min, Anatoly Artemenko, Larisa Shitikova, Lubov’ Mudrik, Tatjana Gridina, Eugene Muratov

Journal:

Antiviral Research

Year:

2007

Language:

english

File:

PDF, 60 KB

english, 2007

6

Application of Computational Techniques in Pharmacy and Medicine || Structure, Thermodynamics and Energetics of Drug-DNA Interactions: Computer Modeling and Experiment

Gorb, Leonid, Kuz'min, Victor, Muratov, Eugene

Year:

2014

Language:

english

File:

PDF, 1.93 MB

english, 2014

7

Structural and Physico-Chemical Interpretation (SPCI) of QSAR Models and Its Comparison with Matched Molecular Pair Analysis

Polishchuk, Pavel, Tinkov, Oleg, Khristova, Tatiana, Ognichenko, Ludmila, Kosinskaya, Anna, Varnek, Alexandre, Kuz’min, Victor

Journal:

Journal of Chemical Information and Modeling

Year:

2016

Language:

english

File:

PDF, 2.92 MB

english, 2016

8

Introduction of simplex-informational descriptors for QSPR analysis of fullerene derivatives

Sizochenko, Natalia, Kuz’min, Victor, Ognichenko, Liudmila, Leszczynski, Jerzy

Journal:

Journal of Mathematical Chemistry

Year:

2016

Language:

english

File:

PDF, 574 KB

english, 2016

9

RGD mimetics containing phthalimidine fragment as novel ligands of fibrinogen receptor

Andrei A. Krysko, Georgiy V. Samoylenko, Pavel G. Polishchuk, Sergei A. Andronati, Tatyana A. Kabanova, Tetiana M. Khristova, Victor E. Kuz’min, Vladimir M. Kabanov, Olga L. Krysko, Alexandre A. Varne

Journal:

Bioorganic & Medicinal Chemistry Letters

Year:

2011

Language:

english

File:

PDF, 546 KB

english, 2011

10

The Effect of Heat Temperature on the Structure of Plasma Coating of the Ni-Cr-Si-B System

Kornienko, Elena, Nikulina, Aelita, Drobyaz, Ekaterina, Plotnikova, Natalya, Lapushkina, Elizaveta, Kuz'min, Victor

Journal:

Applied Mechanics and Materials

Year:

2015

Language:

english

File:

PDF, 2.69 MB

english, 2015

11

QSAR Analysis of Anti-influenza (A/H1N1) Activity of Azolo-adamantanes

Eugene Muratov, Ekaterina Varlamova, Anatoly Artemenko, Victor Kuz’min, Pavel Anfimov, Vladimir Zarubaev, Victor Saraev, Oleg Kiselev

Journal:

Antiviral Research

Year:

2011

Language:

english

File:

PDF, 68 KB

english, 2011

12

SPIE Proceedings [SPIE SPIE Proceedings - (Sunday 12 February 2012)] - Pulsed lasers operating from UV to IR at TRINITI for possible medical applications

Rodin, Anatoly V., Borisov, Vladimir M., Kuz'min, Victor N., Mezhevov, Vladimir S., Wang, Ruikang K., Hebden, Jeremy C., Priezzhev, Alexander V., Tuchin, Valery V.

Year:

2012

Language:

english

File:

PDF, 294 KB

english, 2012

13

QSPR Models for Predicting of the Melting Points and Refractive Indices for Inorganic Substances

Kuz'min, Victor E., Ognichenko, Liudmila N., Zinchenko, Viktor F., Artemenko, Anatoly G., Shyrykalova, Angela O., Kozhukhar, Anna V.

Journal:

International Journal of Quantitative Structure-Property Relationships

Year:

2020

File:

PDF, 853 KB

2020

14

SPIE Proceedings [SPIE Photonics West '96 - San Jose, CA (Saturday 27 January 1996)] Gas and Chemical Lasers - Cryogenic high-power CO laser pumped by e-beam sustained discharge: theory and experiment

Napartovich, Anatoly P., Gurashvili, V. A., Kochetov, Igor, Kuz'min, Victor N., Kurnosov, Alexander K., Loboiko, Alexander I., Turkin, Nikolay G., Sze, Robert C.

Year:

1996

Language:

english

File:

PDF, 526 KB

english, 1996

15

Novel enhanced applications of QSPR models: Temperature dependence of aqueous solubility

Klimenko, Kyrylo, Kuz'min, Victor, Ognichenko, Liudmila, Gorb, Leonid, Shukla, Manoj, Vinas, Natalia, Perkins, Edward, Polishchuk, Pavel, Artemenko, Anatoly, Leszczynski, Jerzy

Journal:

Journal of Computational Chemistry

Year:

2016

Language:

english

File:

PDF, 482 KB

english, 2016

16

The effect of the structure of derivatives of nitrogen-containing heterocycles on their anti-influenza activity

Gridina, Tatyana L., Fedchuk, Alla S., Basok, Stephan S., Artemenko, Anatoliy G., Ognichenko, Liudmila N., Shitikova, Larisa I., Lutsyuk, Anatolii F., Gruzevskii, Aleksandr A., Kuz’min, Victor E.

Journal:

Chemistry of Heterocyclic Compounds

Year:

2019

Language:

english

File:

PDF, 302 KB

english, 2019

17

Application of Computational Techniques in Pharmacy and Medicine || Molecular Structures, Relative Stability, and Proton Affinities of Nucleotides: Broad View and Novel Findings

Gorb, Leonid, Kuz'min, Victor, Muratov, Eugene

Year:

2014

Language:

english

File:

PDF, 2.10 MB

english, 2014

18

Lattice Model for QSAR Studies

VictorE. Kuz’min, AnatolyG. Artemenko, NikolayA. Kovdienko, IgorV. Tetko, DavidJ. Livingstone

Journal:

Journal of Molecular Modeling

Year:

2000

Language:

english

File:

PDF, 129 KB

english, 2000

19

Synthesis, biological evaluation, X-ray molecular structure and molecular docking studies of RGD mimetics containing 6-amino-2,3-dihydroisoindolin-1-one fragment as ligands of integrin αIIbβ3

Krysko, Andrei A., Samoylenko, Georgiy V., Polishchuk, Pavel G., Fonari, Marina S., Kravtsov, Victor Ch., Andronati, Sergei A., Kabanova, Tatyana A., Lipkowski, Janusz, Khristova, Tetiana M., Kuz’min,

Journal:

Bioorganic & Medicinal Chemistry

Year:

2013

Language:

english

File:

PDF, 2.85 MB

english, 2013

20

New Structural Descriptors of Molecules on the Basis of Symbiosis of the Informational Field Model and Simplex Representation of Molecular Structure

Lyudmila N. Ognichenko, Victor E. Kuz'min, Anatoly G. Artemenko

Journal:

Molecular Informatics

Year:

2009

Language:

english

File:

PDF, 462 KB

english, 2009

21

Application of Computational Techniques in Pharmacy and Medicine ||

Gorb, Leonid, Kuz'min, Victor, Muratov, Eugene

Year:

2014

Language:

english

File:

PDF, 17.04 MB

english, 2014

22

Researches Structure and Properties of Self-Fluxing Coating, Obtained by Air-Plasma Spraying

Kornienko, Elena, Smirnov, Alexander, Kuz'min, Victor

Journal:

Applied Mechanics and Materials

Year:

2014

Language:

english

File:

PDF, 1.26 MB

english, 2014

23

SPIE Proceedings [SPIE Selected Papers from Seventh Internation Conference on Advanced Laser Technologies (ALT'98): Laser Methods in Medicine and Biology - Tallin, Estonia (Monday 26 October 1998)] ALT'98 Selected Papers on Novel Laser Methods in Medicine and Biology - UV diode-pumped solid state laser for medical applications

Apollonov, Victor V., Konstantinov, K. V., Sirotkin, A. A., Prokhorov, Alexander M., Pustovoy, Vladimir I., Kuz'min, Genadi P.

Year:

1999

Language:

english

File:

PDF, 291 KB

english, 1999

24

Application of Random Forest and Multiple Linear Regression Techniques to QSPR Prediction of an Aqueous Solubility for Military Compounds

Nikolay A. Kovdienko, Pavel G. Polishchuk, Eugene N. Muratov , Anatoly G. Artemenko, Victor E. Kuz'min, Leonid Gorb, Frances Hill, Jerzy Leszczynski

Journal:

Molecular Informatics

Year:

2010

Language:

english

File:

PDF, 502 KB

english, 2010

25

Application of Quantum Chemical Approximations to Environmental Problems: Prediction of Water Solubility for Nitro Compounds

Kholod, Yana A., Muratov, Eugene N., Gorb, Leonid G., Hill, Frances C., Artemenko, Anatoly G., Kuz’min, Victor E., Qasim, Mohammad, Leszczynski, Jerzy

Journal:

Environmental Science & Technology

Year:

2009

Language:

english

File:

PDF, 120 KB

english, 2009

26

QSAR analysis of [(biphenyloxy)propyl]isoxazoles: agents against coxsackievirus B3

Muratov, Eugene N, Varlamova, Ekaterina V, Artemenko, Anatoly G, Khristova, Tat’yana, Kuz’min, Victor E, Makarov, Vadim A, Riabova, Olga B, Wutzler, Peter, Schmidtke, Michaela

Journal:

Future Medicinal Chemistry

Year:

2011

Language:

english

File:

PDF, 1.52 MB

english, 2011

27

Synthesis of 5,5'-dinitro-2,2'-bis(polynitromethyl)-bi(1,2,3(4)-triazoles), hydrogen-free oxidizers

Semenov, Victor V., Shevelev, Svyatoslav A., Bruskin, Alexander B., Shakhnes, Alexander Kh., Kuz’min, Vladimir S.

Journal:

Chemistry of Heterocyclic Compounds

Year:

2017

Language:

english

File:

PDF, 444 KB

english, 2017

28

HiT QSAR Study of Antivirals’ Bioavailability

Anatoly Artemenko, Eugene Muratov, Victor Kuz’min, Maxim Kulinskij, Irina Borisuk, Nikolay Golovenko, Alexander Tropsha

Journal:

Antiviral Research

Year:

2009

Language:

english

File:

PDF, 88 KB

english, 2009

29

Toxicity of nanomaterials: Availability and suitability of data for the development of in silico models

Richarz, Andrea-Nicole, Cronin, Mark, Madden, Judith, Lubinski, Lukasz, Mokshina, Elena, Urbaszek, Piotr, Puzyn, Tomasz, Kuz’min, Victor

Journal:

Toxicology Letters

Year:

2013

Language:

english

File:

PDF, 80 KB

english, 2013

30

Quantitative Structure−Activity Relationship Studies of [(Biphenyloxy)propyl]isoxazole Derivatives. Inhibitors of Human Rhinovirus 2 Replication

Kuz'min, Victor E., Artemenko, Anatoly G., Muratov, Eugene N., Volineckaya, Ingrid L., Makarov, Vadim A., Riabova, Olga B., Wutzler, Peter, Schmidtke, Michaela

Journal:

Journal of Medicinal Chemistry

Year:

2007

Language:

english

File:

PDF, 436 KB

english, 2007

31

Development of computational models for the prediction of the toxicity of nanomaterials

Richarz, Andrea-Nicole, Madden, Judith C., Marchese Robinson, Richard L., Lubiński, Łukasz, Mokshina, Elena, Urbaszek, Piotr, Kuz׳min, Victor E., Puzyn, Tomasz, Cronin, Mark T.D.

Journal:

Perspectives in Science

Year:

2015

Language:

english

File:

PDF, 483 KB

english, 2015

32

SPIE Proceedings [SPIE ALT'99 International Conference: Advanced Laser Technologies - Potenza-Lecce, Italy (Monday 20 September 1999)] ALT '99 International Conference on Advanced Laser Technologies - Structure and optical properties of silicon nanopowders produced by laser-induced SiH4 gas decomposition

Kuz'min, Genadi P., Karasev, M. E., Khokhlov, E. M., Kononov, N. N., Korovin, S. B., Plotnichenko, Victor G., Polyakov, Sergey N., Pustovoy, Vladimir I., Tikhonevitch, O. V., Pustovoy, Vladimir I., Ko

Year:

2000

Language:

english

File:

PDF, 892 KB

english, 2000

33

Computational assessment of environmental hazards of nitroaromatic compounds: influence of the type and position of aromatic ring substituents on toxicity

Tinkov, Oleg V., Ognichenko, Luidmila N., Kuz’min, Victor E., Gorb, Leonid G., Kosinskaya, Anna P., Muratov, Nail N., Muratov, Eugene N., Hill, Frances C., Leszczynski, Jerzy

Journal:

Structural Chemistry

Year:

2016

Language:

english

File:

PDF, 1.50 MB

english, 2016

34

Modeling of the informational field of molecules

Victor E. Kuz'min, Ludmila N. Ognichenko, Anatoly G. Artemenko

Journal:

Journal of Molecular Modeling

Year:

2001

Language:

english

File:

PDF, 378 KB

english, 2001

35

Application of Random Forest Approach to QSAR Prediction of Aquatic Toxicity

Polishchuk, Pavel G., Muratov, Eugene N., Artemenko, Anatoly G., Kolumbin, Oleg G., Muratov, Nail N., Kuz’min, Victor E.

Journal:

Journal of Chemical Information and Modeling

Year:

2009

Language:

english

File:

PDF, 414 KB

english, 2009

36

Alarms about structural alerts

Alves, Vinicius, Muratov, Eugene, capuzzi, Stephen, Politi, Regina, Low, Yen, Braga, Rodolpho, Zakharov, Alexey, Sedykh, Alexander, Mokshyna, Elena, Farag, Sherif, Andrade, carolina, Kuz'min, Victor,

Journal:

Green Chemistry

Year:

2016

Language:

english

File:

PDF, 2.34 MB

english, 2016

37

Stereodesign of chiralpara-substituted calix[4]arenes

Socrates Alikhanidi, Victor Kuz’min

Journal:

Journal of Molecular Modeling

Year:

2001

Language:

english

File:

PDF, 105 KB

english, 2001

38

QSAR Modeling and Prediction of Drug-Drug Interactions

Zakharov, Alexey V., Varlamova, Ekaterina V., Lagunin, Alexey A., Dmitriev, Alexander V., Muratov, Eugene N., Fourches, Denis, Kuz'min, Victor E., Poroikov, Vladimir V., Tropsha, Alexander, Nicklaus,

Journal:

Molecular Pharmaceutics

Year:

2015

Language:

english

File:

PDF, 1.26 MB

english, 2015

39

QSAR Analysis of Poliovirus Inhibition By Dual Combinations of Antivirals

Eugene N. Muratov, Ekaterina V. Varlamova, Victor E. Kuz’min, Anatoly G. Artemenko, Lubomira Nikolaeva-Glomb, Angel S. Galabov

Journal:

Antiviral Research

Year:

2010

Language:

english

File:

PDF, 74 KB

english, 2010

40

New QSPR equations for prediction of aqueous solubility for military compounds

Eugene N. Muratov, Victor E. Kuz’min, Anatoly G. Artemenko, Nikolay A. Kovdienko, Leonid Gorb, Frances Hill, Jerzy Leszczynski

Journal:

Year:

2010

Language:

english

File:

PDF, 197 KB

english, 2010

41

Application of Computational Techniques in Pharmacy and Medicine || Density Functional Theory Calculations of Enzyme–Inhibitor Interactions in Medicinal Chemistry and Drug Design

Gorb, Leonid, Kuz'min, Victor, Muratov, Eugene

Year:

2014

Language:

english

File:

PDF, 2.35 MB

english, 2014

42

The effects of characteristics of substituents on toxicity of the nitroaromatics: HiT QSAR study

Victor E. Kuz’min, Eugene N. Muratov, Anatoly G. Artemenko, Leonid Gorb, Mohammad Qasim, Jerzy Leszczynski

Journal:

Journal of Computer-Aided Molecular Design

Year:

2008

Language:

english

File:

PDF, 610 KB

english, 2008

43

Causal inference methods to assist in mechanistic interpretation of classification nano-SAR models

Sizochenko, Natalia, Rasulev, Bakhtiyor, Gajewicz, Agnieszka, Mokshyna, Elena, Kuz'min, Victor E., Leszczynski, Jerzy, Puzyn, Tomasz

Journal:

Year:

2015

Language:

english

File:

PDF, 473 KB

english, 2015

44

Consensus QSAR Modeling of Phosphor-Containing Chiral AChE Inhibitors

Victor E. Kuz'min, Eugene N. Muratov, Anatoly G. Artemenko, Ekaterina V. Varlamova, Leonid Gorb, Jing Wang, Jerzy Leszczynski

Journal:

Molecular Informatics

Year:

2009

Language:

english

File:

PDF, 442 KB

english, 2009

45

From basic physics to mechanisms of toxicity: the “liquid drop” approach applied to develop predictive classification models for toxicity of metal oxide nanoparticles

Sizochenko, Natalia, Rasulev, Bakhtiyor, Gajewicz, Agnieszka, Kuz'min, Victor, Puzyn, Tomasz, Leszczynski, Jerzy

Journal:

Year:

2014

Language:

english

File:

PDF, 974 KB

english, 2014

46

Application of Computational Techniques in Pharmacy and Medicine || Hybrid QM/MM Methods: Treating Electronic Phenomena in Very Large Molecular Systems

Gorb, Leonid, Kuz'min, Victor, Muratov, Eugene

Year:

2014

Language:

english

File:

PDF, 1.51 MB

english, 2014

47

New Methods of Obtaining Al–Si Alloys Using Amorphous Microsilica

Kuz’min, Mikhail P., Larionov, Leonid M., Chu, Paul K., Qasim, Abdul M., Kuz’mina, Marina Yu., Kondratiev, Victor V., Kuz’mina, Alina S., Ran, Jia Q.

Journal:

International Journal of Metalcasting

Year:

2019

Language:

english

File:

PDF, 1.86 MB

english, 2019

48

QSAR Analysis of Antimicrobial Activity of 4-thiazolidone Derivatives

Anatoliy G. Artemenko, Eugene N. Muratov, Dmytro V. Atamanyuk, Victor E. Kuz'min, Alexander I. Hromov, Roman V. Kutsyk, Roman B. Lesyk

Journal:

Molecular Informatics

Year:

2009

Language:

english

File:

PDF, 591 KB

english, 2009

49

Universal Approach for Structural Interpretation of QSAR/QSPR Models

Polishchuk, Pavel G., Kuz'min, Victor E., Artemenko, Anatoly G., Muratov, Eugene N.

Journal:

Molecular Informatics

Year:

2013

Language:

english

File:

PDF, 841 KB

english, 2013

50

Application of Computational Techniques in Pharmacy and Medicine || Quantum-Chemical Investigation of Epoxidic Compounds Transformation. Application for In Vitro and In Vivo Processes Modeling

Gorb, Leonid, Kuz'min, Victor, Muratov, Eugene

Year:

2014

Language:

english

File:

PDF, 2.78 MB

english, 2014

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