Sergii Novotarskyi

15 papers Journal 14
YearRankTypeTitle / Venue / Authors
2014 J jnl
How Accurately Can We Predict the Melting Points of Drug-like Compounds?
J. Chem. Inf. Model.
Igor V. Tetko, Yurii Sushko, Sergii Novotarskyi, Luc Patiny, Ivan Kondratov, Alexander E. Petrenko, Larisa Charochkina, Abdullah M. Asiri
2014 J jnl
Prediction-driven matched molecular pairs to interpret QSARs and aid the molecular optimization process.
J. Cheminformatics
Yurii Sushko, Sergii Novotarskyi, Robert Körner, Joachim Vogt, Ahmed Abdelaziz, Igor V. Tetko
2013 J jnl
Chemogenomic approach to increase accuracy of QSAR modeling of inhibition activity against five major P450 isoforms.
J. Cheminformatics
Sergii Novotarskyi, Iurii Sushko, Robert Körner, Igor V. Tetko
2013 J jnl
Development of Dimethyl Sulfoxide Solubility Models Using 163 000 Molecules: Using a Domain Applicability Metric to Select More Reliable Predictions.
J. Chem. Inf. Model.
Igor V. Tetko, Sergii Novotarskyi, Iurii Sushko, Vladimir Ivanov, Alexander E. Petrenko, Reiner Dieden, Florence Lebon, Benoît Mathieu
2013 J jnl
Modeling of non-additive mixture properties using the Online CHEmical database and Modeling environment (OCHEM).
J. Cheminformatics
Ioana Oprisiu, Sergii Novotarskyi, Igor V. Tetko
2013 — —
QSAR approaches to predict human cytochrome P450 inhibition (QSAR-basierter Ansatz zur Vorhersage der Enzymhemmung von humanem Cytochrom P450)
Sergii Novotarskyi
2012 J jnl
In silico pK
J. Cheminformatics
Robert Körner, Iurii Sushko, Sergii Novotarskyi, Igor V. Tetko
2012 J jnl
QSAR modeling for In vitro assays: linking ToxCast™ database to the integrated modeling framework "OCHEM".
J. Cheminformatics
Ahmed Abdelaziz, Iurii Sushko, Wolfram Teetz, Robert Körner, Sergii Novotarskyi, Igor V. Tetko
2011 J jnl
A comparison of different QSAR approaches to modeling CYP450 1A2 inhibition.
J. Chem. Inf. Model.
Sergii Novotarskyi, Iurii Sushko, Robert Körner, Anil Kumar Pandey, Igor V. Tetko
2011 J jnl
Online chemical modeling environment (OCHEM): web platform for data storage, model development and publishing of chemical information.
J. Comput. Aided Mol. Des.
Iurii Sushko, Sergii Novotarskyi, Robert Körner, Anil Kumar Pandey, Matthias Rupp, Wolfram Teetz, Stefan Brandmaier, Ahmed Abdelaziz, Volodymyr V. Prokopenko, Vsevolod Yu. Tanchuk, Roberto Todeschini, Alexandre Varnek, Gilles Marcou, Peter Ertl, Vladimir Potemkin, Maria A. Grishina, Johann Gasteiger, Christof H. Schwab, Igor I. Baskin, Vladimir A. Palyulin, Eugene V. Radchenko, William J. Welsh, Vladyslav V. Kholodovych, Dmitriy Chekmarev, Artem Cherkasov, João Aires-de-Sousa, Qing-You Zhang, Andreas Bender, Florian Nigsch, Luc Patiny, Antony J. Williams, Valery Tkachenko, Igor V. Tetko
2011 J jnl
Online chemical modeling environment (OCHEM): web platform for data storage, model development and publishing of chemical information.
J. Cheminformatics
Iurii Sushko, Anil Kumar Pandey, Sergii Novotarskyi, Robert Körner, Matthias Rupp, Wolfram Teetz, Stefan Brandmaier, Ahmed Abdelaziz, Volodymyr V. Prokopenko, Vsevolod Yu. Tanchuk, Roberto Todeschini, Alexandre Varnek, Gilles Marcou, Peter Ertl, Vladimir Potemkin, Maria A. Grishina, Johann Gasteiger, Igor I. Baskin, Vladimir A. Palyulin, Eugene V. Radchenko, William J. Welsh, Vladyslav V. Kholodovych, Dmitriy Chekmarev, Artem Cherkasov, João Aires-de-Sousa, Qing-You Zhang, Andreas Bender, Florian Nigsch, Luc Patiny, Antony J. Williams, Valery Tkachenko, Igor V. Tetko
2010 J jnl
Applicability Domains for Classification Problems: Benchmarking of Distance to Models for Ames Mutagenicity Set.
J. Chem. Inf. Model.
Iurii Sushko, Sergii Novotarskyi, Robert Körner, Anil Kumar Pandey, Artem Cherkasov, Jiazhong Li, Paola Gramatica, Katja Hansen, Timon Schroeter, Klaus-Robert Müller, Lili Xi, Huanxiang Liu, Xiaojun Yao, Tomas Öberg, Farhad Hormozdiari, Phuong Dao, Süleyman Cenk Sahinalp, Roberto Todeschini, Pavel G. Polishchuk, Anatoly G. Artemenko, Victor Kuzmin, Todd M. Martin, Douglas M. Young, Denis Fourches, Eugene N. Muratov, Alexander Tropsha, Igor I. Baskin, Dragos Horvath, Gilles Marcou, Christophe Muller, Alexandre Varnek, Volodymyr V. Prokopenko, Igor V. Tetko
2010 J jnl
Applicability domain for classification problems.
J. Cheminformatics
Iurii Sushko, Sergii Novotarskyi, Anil Kumar Pandey, Robert Körner, Igor V. Tetko
2010 J jnl
Classification of CYP450 1A2 inhibitors using PubChem data.
J. Cheminformatics
Sergii Novotarskyi, Iurii Sushko, Robert Körner, Anil Kumar Pandey, Igor V. Tetko
2010 J jnl
OCHEM - on-line CHEmical database & modeling environment.
J. Cheminformatics
Sergii Novotarskyi, Iurii Sushko, Robert Körner, Anil Kumar Pandey, Matthias Rupp, Volodymyr V. Prokopenko, Igor V. Tetko