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Journal of Chemical Information and Modeling
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October 11, 2014
Improving the use of ranking in virtual screening against HIV-1 integrase with triangular numbers and including ligand profiling with antitargets
Alfonso T García-Sosa, Uko Maran
Journal of Hazardous Materials
|
October 4, 2023
Pesticide effect on earthworm lethality via interpretable machine learning
Mihkel Kotli, Geven Piir, Uko Maran
Chemosphere
|
November 11, 2023
Interpretable machine learning for the identification of estrogen receptor agonists, antagonists, and binders
Geven Piir, Sulev Sild, Uko Maran
Chemosphere
|
November 13, 2020
Binary and multi-class classification for androgen receptor agonists, antagonists and binders
Geven Piir, Sulev Sild, Uko Maran
International Journal of Molecular Sciences
|
July 2, 2021
Combined Naïve Bayesian, Chemical Fingerprints and Molecular Docking Classifiers to Model and Predict Androgen Receptor Binding Data for Environmentally- and Health-Sensitive Substances
Alfonso T García-Sosa, Uko Maran
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
Journal of Chemical Information and Modeling
|
October 14, 2008
Design of multi-binding-site inhibitors, ligand efficiency, and consensus screening of avian influenza H5N1 wild-type neuraminidase and of the oseltamivir-resistant H274Y variant
Alfonso T García-Sosa, Sulev Sild, Uko Maran
Journal of Molecular Graphics & Modelling
|
July 25, 2017
Chemical structure and correlation analysis of HIV-1 NNRT and NRT inhibitors and database-curated, published inhibition constants with chemical structure in diverse datasets
Birgit Viira, Alfonso T García-Sosa, Uko Maran
Journal of Computational Chemistry
|
May 8, 2009
Drug efficiency indices for improvement of molecular docking scoring functions
Alfonso T García-Sosa, Csaba Hetényi, Uko Maran
Pharmaceutics
|
October 27, 2022
Intrinsic Aqueous Solubility: Mechanistically Transparent Data-Driven Modeling of Drug Substances
Mare Oja, Sulev Sild, Geven Piir, et al.
Page
of 6
Search research articles
Search
Showing results (11-20 of 58) with videos related to
Sort By:
Page
of 6
Journal of Chemical Information and Modeling
|
October 11, 2014
Improving the use of ranking in virtual screening against HIV-1 integrase with triangular numbers and including ligand profiling with antitargets
Alfonso T García-Sosa, Uko Maran
Journal of Hazardous Materials
|
October 4, 2023
Pesticide effect on earthworm lethality via interpretable machine learning
Mihkel Kotli, Geven Piir, Uko Maran
Chemosphere
|
November 11, 2023
Interpretable machine learning for the identification of estrogen receptor agonists, antagonists, and binders
Geven Piir, Sulev Sild, Uko Maran
Chemosphere
|
November 13, 2020
Binary and multi-class classification for androgen receptor agonists, antagonists and binders
Geven Piir, Sulev Sild, Uko Maran
International Journal of Molecular Sciences
|
July 2, 2021
Combined Naïve Bayesian, Chemical Fingerprints and Molecular Docking Classifiers to Model and Predict Androgen Receptor Binding Data for Environmentally- and Health-Sensitive Substances
Alfonso T García-Sosa, Uko Maran
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
Journal of Chemical Information and Modeling
|
October 14, 2008
Design of multi-binding-site inhibitors, ligand efficiency, and consensus screening of avian influenza H5N1 wild-type neuraminidase and of the oseltamivir-resistant H274Y variant
Alfonso T García-Sosa, Sulev Sild, Uko Maran
Journal of Molecular Graphics & Modelling
|
July 25, 2017
Chemical structure and correlation analysis of HIV-1 NNRT and NRT inhibitors and database-curated, published inhibition constants with chemical structure in diverse datasets
Birgit Viira, Alfonso T García-Sosa, Uko Maran
Journal of Computational Chemistry
|
May 8, 2009
Drug efficiency indices for improvement of molecular docking scoring functions
Alfonso T García-Sosa, Csaba Hetényi, Uko Maran
Pharmaceutics
|
October 27, 2022
Intrinsic Aqueous Solubility: Mechanistically Transparent Data-Driven Modeling of Drug Substances
Mare Oja, Sulev Sild, Geven Piir, et al.
Page
of 6