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Journal of Cheminformatics
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August 11, 2024
MolCompass: multi-tool for the navigation in chemical space and visual validation of QSAR/QSPR models
Sergey Sosnin
Drug Discovery Today
|
June 2, 2025
Chemical space visual navigation in the era of deep learning and Big Data
Sergey Sosnin
ACS Omega
|
November 22, 2021
Exploring Chemical Reaction Space with Reaction Difference Fingerprints and Parametric t-SNE
Mikhail Andronov, Maxim V Fedorov, Sergey Sosnin
Journal of Computer-Aided Molecular Design
|
March 21, 2023
Improvement of multi-task learning by data enrichment: application for drug discovery
Ekaterina A Sosnina, Sergey Sosnin, Maxim V Fedorov
Scientific Reports
|
July 21, 2021
Transformer-based artificial neural networks for the conversion between chemical notations
Lev Krasnov, Ivan Khokhlov, Maxim V Fedorov, et al.
Molecular Informatics
|
January 30, 2024
The macrocycle inhibitor landscape of SLC-transporter
Nejra Granulo, Sergey Sosnin, Daniela Digles, et al.
Chemical Research in Toxicology
|
July 13, 2023
Identifying Differences in the Performance of Machine Learning Models for Off-Targets Trained on Publicly Available and Proprietary Data Sets
Aljoša Smajić, Iris Rami, Sergey Sosnin, et al.
ACS Omega
|
March 24, 2020
graphDelta: MPNN Scoring Function for the Affinity Prediction of Protein-Ligand Complexes
Dmitry S Karlov, Sergey Sosnin, Maxim V Fedorov, et al.
Journal of Chemical Information and Modeling
|
December 28, 2018
Comparative Study of Multitask Toxicity Modeling on a Broad Chemical Space
Sergey Sosnin, Dmitry Karlov, Igor V Tetko, et al.
Journal of Physics. Condensed Matter : an Institute of Physics Journal
|
July 3, 2018
3D matters! 3D-RISM and 3D convolutional neural network for accurate bioaccumulation prediction
Sergey Sosnin, Maksim Misin, David S Palmer, et al.
Page
of 3
Search research articles
Search
Showing results (1-10 of 22) with videos related to
Sort By:
Page
of 3
Journal of Cheminformatics
|
August 11, 2024
MolCompass: multi-tool for the navigation in chemical space and visual validation of QSAR/QSPR models
Sergey Sosnin
Drug Discovery Today
|
June 2, 2025
Chemical space visual navigation in the era of deep learning and Big Data
Sergey Sosnin
ACS Omega
|
November 22, 2021
Exploring Chemical Reaction Space with Reaction Difference Fingerprints and Parametric t-SNE
Mikhail Andronov, Maxim V Fedorov, Sergey Sosnin
Journal of Computer-Aided Molecular Design
|
March 21, 2023
Improvement of multi-task learning by data enrichment: application for drug discovery
Ekaterina A Sosnina, Sergey Sosnin, Maxim V Fedorov
Scientific Reports
|
July 21, 2021
Transformer-based artificial neural networks for the conversion between chemical notations
Lev Krasnov, Ivan Khokhlov, Maxim V Fedorov, et al.
Molecular Informatics
|
January 30, 2024
The macrocycle inhibitor landscape of SLC-transporter
Nejra Granulo, Sergey Sosnin, Daniela Digles, et al.
Chemical Research in Toxicology
|
July 13, 2023
Identifying Differences in the Performance of Machine Learning Models for Off-Targets Trained on Publicly Available and Proprietary Data Sets
Aljoša Smajić, Iris Rami, Sergey Sosnin, et al.
ACS Omega
|
March 24, 2020
graphDelta: MPNN Scoring Function for the Affinity Prediction of Protein-Ligand Complexes
Dmitry S Karlov, Sergey Sosnin, Maxim V Fedorov, et al.
Journal of Chemical Information and Modeling
|
December 28, 2018
Comparative Study of Multitask Toxicity Modeling on a Broad Chemical Space
Sergey Sosnin, Dmitry Karlov, Igor V Tetko, et al.
Journal of Physics. Condensed Matter : an Institute of Physics Journal
|
July 3, 2018
3D matters! 3D-RISM and 3D convolutional neural network for accurate bioaccumulation prediction
Sergey Sosnin, Maksim Misin, David S Palmer, et al.
Page
of 3