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Igor V Tetko

Showing results (31-40 of 126) with videos related to

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Journal of Cheminformatics|December 9, 2024
Be aware of overfitting by hyperparameter optimization!Igor V Tetko, Ruud van Deursen, Guillaume Godin
Journal of Computer-Aided Molecular Design|November 4, 2005
Surrogate data--a secure way to share corporate dataIgor V Tetko, Ruben Abagyan, Tudor I Oprea
Alternatives to Laboratory Animals : ATLA|April 26, 2013
From descriptors to predicted properties: experimental design by using applicability domain estimationStefan Brandmaier, Sergii Novotarskyi, Iurii Sushko, et al.
Journal of Chemical Information and Modeling|April 3, 2012
PLS-optimal: a stepwise D-optimal design based on latent variablesStefan Brandmaier, Ullrika Sahlin, Igor V Tetko, et al.
Journal of Computer-Aided Molecular Design|November 3, 2019
Focused Library Generator: case of Mdmx inhibitorsZhonghua Xia, Pavel Karpov, Grzegorz Popowicz, et al.
Chemical Research in Toxicology|August 8, 2025
Advancing Human and Environmental Safety Science Using <i>In Silico</i> MethodsAlessandra Roncaglioni, Simona Kovarich, Kamel Mansouri, et al.
Current Medicinal Chemistry|February 14, 2006
In silico approaches to prediction of aqueous and DMSO solubility of drug-like compounds: trends, problems and solutionsKonstantin V Balakin, Nikolay P Savchuk, Igor V Tetko
Nucleic Acids Research|January 13, 2006
A systematic approach to infer biological relevance and biases of gene network structuresAlexey V Antonov, Igor V Tetko, Hans W Mewes
Journal of Cheminformatics|January 26, 2016
The development of models to predict melting and pyrolysis point data associated with several hundred thousand compounds mined from PATENTSIgor V Tetko, Daniel M Lowe, Antony J Williams
BMC Bioinformatics|April 5, 2005
Super paramagnetic clustering of protein sequencesIgor V Tetko, Axel Facius, Andreas Ruepp, et al.
Pageof 13

Showing results (31-40 of 126) with videos related to

Sort By:
Pageof 13
Journal of Cheminformatics|December 9, 2024
Be aware of overfitting by hyperparameter optimization!Igor V Tetko, Ruud van Deursen, Guillaume Godin
Journal of Computer-Aided Molecular Design|November 4, 2005
Surrogate data--a secure way to share corporate dataIgor V Tetko, Ruben Abagyan, Tudor I Oprea
Alternatives to Laboratory Animals : ATLA|April 26, 2013
From descriptors to predicted properties: experimental design by using applicability domain estimationStefan Brandmaier, Sergii Novotarskyi, Iurii Sushko, et al.
Journal of Chemical Information and Modeling|April 3, 2012
PLS-optimal: a stepwise D-optimal design based on latent variablesStefan Brandmaier, Ullrika Sahlin, Igor V Tetko, et al.
Journal of Computer-Aided Molecular Design|November 3, 2019
Focused Library Generator: case of Mdmx inhibitorsZhonghua Xia, Pavel Karpov, Grzegorz Popowicz, et al.
Chemical Research in Toxicology|August 8, 2025
Advancing Human and Environmental Safety Science Using <i>In Silico</i> MethodsAlessandra Roncaglioni, Simona Kovarich, Kamel Mansouri, et al.
Current Medicinal Chemistry|February 14, 2006
In silico approaches to prediction of aqueous and DMSO solubility of drug-like compounds: trends, problems and solutionsKonstantin V Balakin, Nikolay P Savchuk, Igor V Tetko
Nucleic Acids Research|January 13, 2006
A systematic approach to infer biological relevance and biases of gene network structuresAlexey V Antonov, Igor V Tetko, Hans W Mewes
Journal of Cheminformatics|January 26, 2016
The development of models to predict melting and pyrolysis point data associated with several hundred thousand compounds mined from PATENTSIgor V Tetko, Daniel M Lowe, Antony J Williams
BMC Bioinformatics|April 5, 2005
Super paramagnetic clustering of protein sequencesIgor V Tetko, Axel Facius, Andreas Ruepp, et al.
Pageof 13