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

Sushko, Iurii ; Novotarskyi, Sergii ; Körner, Robert ; Pandey, Anil Kumar ; Rupp, Matthias ; Teetz, Wolfram ; Brandmaier, Stefan ; Abdelaziz, Ahmed ; Prokopenko, Volodymyr V ; Tanchuk, Vsevolod Y ; Todeschini, Roberto ; Varnek, Alexandre ; Marcou, Gilles ; Ertl, Peter ; Potemkin, Vladimir ; Grishina, Maria ; Gasteiger, Johann ; Schwab, Christof ; Baskin, Igor I ; Palyulin, Vladimir A ; Radchenko, Eugene V ; Welsh, William J ; Kholodovych, Vladyslav ; Chekmarev, Dmitriy ; Cherkasov, Artem ; Aires-de-Sousa, Joao ; Zhang, Qing-You ; Bender, Andreas ; Nigsch, Florian ; Patiny, Luc ; Williams, Antony ; Tkachenko, Valery ; Tetko, Igor V

Journal of computer-aided molecular design, 2011-06-10, Vol.25 (6), p.533-554 [Peer Reviewed Journal]

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2
Classification of CYP450 1A2 inhibitors using PubChem data
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Article
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Classification of CYP450 1A2 inhibitors using PubChem data

Novotarskyi, Sergii ; Sushko, Iurii ; Körner, R ; Pandey, AK ; Tetko, Igor

Journal of cheminformatics, 2010-05, Vol.2 (S1), p.1-1 [Peer Reviewed Journal]

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3
Applicability domain for classification problems
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Article
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Applicability domain for classification problems

Sushko, Iurii ; Novotarskyi, S ; Pandey, AK ; Körner, R ; Tetko, Igor

Journal of cheminformatics, 2010-05, Vol.2 (S1), p.1-1 [Peer Reviewed Journal]

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4
OCHEM - on-line CHEmical database & modeling environment
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Article
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OCHEM - on-line CHEmical database & modeling environment

Novotarskyi, Sergii ; Sushko, Iurii ; Körner, R ; Kumar, Pandey Anil ; Rupp, Matthias ; Prokopenko, VV ; Tetko, Igor

Journal of cheminformatics, 2010-05, Vol.2 (S1), p.1-1 [Peer Reviewed Journal]

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