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Molecular Informatics
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August 4, 2016
Modeling the Biodegradability of Chemical Compounds Using the Online CHEmical Modeling Environment (OCHEM)
Susann Vorberg, Igor V Tetko
Journal of Cheminformatics
|
December 19, 2020
From Big Data to Artificial Intelligence: chemoinformatics meets new challenges
Igor V Tetko, Ola Engkvist
Journal of Medicinal Chemistry
|
October 29, 2004
Application of ALOGPS 2.1 to predict log D distribution coefficient for Pfizer proprietary compounds
Igor V Tetko, Gennadiy I Poda
Chemical Research in Toxicology
|
August 8, 2025
Which Modern AI Methods Provide Accurate Predictions of Toxicological End Points? Analysis of Tox24 Challenge Results
Stephanie A Eytcheson, Igor V Tetko
Journal of Chemical Information and Computer Sciences
|
October 16, 2002
Application of associative neural networks for prediction of lipophilicity in ALOGPS 2.1 program
Igor V Tetko, Vsevolod Yu Tanchuk
Journal of Cheminformatics
|
August 9, 2025
Advanced machine learning for innovative drug discovery
Igor V Tetko, Djork-Arné Clevert
Future Medicinal Chemistry
|
September 16, 2016
Does 'Big Data' exist in medicinal chemistry, and if so, how can it be harnessed?
Igor V Tetko, Ola Engkvist, Hongming Chen
Chemmedchem
|
June 27, 2017
Matched Molecular Pair Analysis on Large Melting Point Datasets: A Big Data Perspective
Michael Withnall, Hongming Chen, Igor V Tetko
Journal of Cheminformatics
|
January 17, 2013
Modeling of non-additive mixture properties using the Online CHEmical database and Modeling environment (OCHEM)
Ioana Oprisiu, Sergii Novotarskyi, Igor V Tetko
Molecular Informatics
|
October 26, 2016
Public (Q)SAR Services, Integrated Modeling Environments, and Model Repositories on the Web: State of the Art and Perspectives for Future Development
Igor V Tetko, Uko Maran, Alexander Tropsha
Page
of 13
Search research articles
Search
Showing results (11-20 of 126) with videos related to
Sort By:
Page
of 13
Molecular Informatics
|
August 4, 2016
Modeling the Biodegradability of Chemical Compounds Using the Online CHEmical Modeling Environment (OCHEM)
Susann Vorberg, Igor V Tetko
Journal of Cheminformatics
|
December 19, 2020
From Big Data to Artificial Intelligence: chemoinformatics meets new challenges
Igor V Tetko, Ola Engkvist
Journal of Medicinal Chemistry
|
October 29, 2004
Application of ALOGPS 2.1 to predict log D distribution coefficient for Pfizer proprietary compounds
Igor V Tetko, Gennadiy I Poda
Chemical Research in Toxicology
|
August 8, 2025
Which Modern AI Methods Provide Accurate Predictions of Toxicological End Points? Analysis of Tox24 Challenge Results
Stephanie A Eytcheson, Igor V Tetko
Journal of Chemical Information and Computer Sciences
|
October 16, 2002
Application of associative neural networks for prediction of lipophilicity in ALOGPS 2.1 program
Igor V Tetko, Vsevolod Yu Tanchuk
Journal of Cheminformatics
|
August 9, 2025
Advanced machine learning for innovative drug discovery
Igor V Tetko, Djork-Arné Clevert
Future Medicinal Chemistry
|
September 16, 2016
Does 'Big Data' exist in medicinal chemistry, and if so, how can it be harnessed?
Igor V Tetko, Ola Engkvist, Hongming Chen
Chemmedchem
|
June 27, 2017
Matched Molecular Pair Analysis on Large Melting Point Datasets: A Big Data Perspective
Michael Withnall, Hongming Chen, Igor V Tetko
Journal of Cheminformatics
|
January 17, 2013
Modeling of non-additive mixture properties using the Online CHEmical database and Modeling environment (OCHEM)
Ioana Oprisiu, Sergii Novotarskyi, Igor V Tetko
Molecular Informatics
|
October 26, 2016
Public (Q)SAR Services, Integrated Modeling Environments, and Model Repositories on the Web: State of the Art and Perspectives for Future Development
Igor V Tetko, Uko Maran, Alexander Tropsha
Page
of 13