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Journal of Chemical Information and Modeling
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April 28, 2025
PROFIS: Design of Target-Focused Libraries by Probing Continuous Fingerprint Space with Recurrent Neural Networks
Hubert Rybka, Tomasz Danel, Sabina Podlewska
Computational and Structural Biotechnology Journal
|
October 26, 2022
Generation of new inhibitors of selected cytochrome P450 subtypes- <i>In silico</i> study
Tomasz Danel, Agnieszka Wojtuch, Sabina Podlewska
Journal of Chemical Information and Modeling
|
May 24, 2023
Generative Models Should at Least Be Able to Design Molecules That Dock Well: A New Benchmark
Tobiasz Ciepliński, Tomasz Danel, Sabina Podlewska, et al.
Journal of Cheminformatics
|
September 19, 2023
Extended study on atomic featurization in graph neural networks for molecular property prediction
Agnieszka Wojtuch, Tomasz Danel, Sabina Podlewska, et al.
Drug Discovery Today
|
November 13, 2022
Docking-based generative approaches in the search for new drug candidates
Tomasz Danel, Jan Łęski, Sabina Podlewska, et al.
Scientific Reports
|
April 8, 2024
Machine learning accelerates pharmacophore-based virtual screening of MAO inhibitors
Marcin Cieślak, Tomasz Danel, Olga Krzysztyńska-Kuleta, et al.
IEEE Transactions on Neural Networks and Learning Systems
|
April 7, 2023
Feature-Based Interpolation and Geodesics in the Latent Spaces of Generative Models
Lukasz Struski, Michal Sadowski, Tomasz Danel, et al.
Journal of Chemical Information and Modeling
|
July 30, 2025
Qsarna: An Online Tool for Smart Chemical Space Navigation in Drug Design
Marcin Cieślak, Jan Łęski, Olga Krzysztyńska-Kuleta, et al.
Journal of Cheminformatics
|
January 12, 2021
Mol-CycleGAN: a generative model for molecular optimization
Łukasz Maziarka, Agnieszka Pocha, Jan Kaczmarczyk, et al.
Journal of Cheminformatics
|
January 4, 2024
Relative molecule self-attention transformer
Łukasz Maziarka, Dawid Majchrowski, Tomasz Danel, et al.
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of 2
Search research articles
Search
Showing results (1-10 of 11) with videos related to
Sort By:
Page
of 2
Journal of Chemical Information and Modeling
|
April 28, 2025
PROFIS: Design of Target-Focused Libraries by Probing Continuous Fingerprint Space with Recurrent Neural Networks
Hubert Rybka, Tomasz Danel, Sabina Podlewska
Computational and Structural Biotechnology Journal
|
October 26, 2022
Generation of new inhibitors of selected cytochrome P450 subtypes- <i>In silico</i> study
Tomasz Danel, Agnieszka Wojtuch, Sabina Podlewska
Journal of Chemical Information and Modeling
|
May 24, 2023
Generative Models Should at Least Be Able to Design Molecules That Dock Well: A New Benchmark
Tobiasz Ciepliński, Tomasz Danel, Sabina Podlewska, et al.
Journal of Cheminformatics
|
September 19, 2023
Extended study on atomic featurization in graph neural networks for molecular property prediction
Agnieszka Wojtuch, Tomasz Danel, Sabina Podlewska, et al.
Drug Discovery Today
|
November 13, 2022
Docking-based generative approaches in the search for new drug candidates
Tomasz Danel, Jan Łęski, Sabina Podlewska, et al.
Scientific Reports
|
April 8, 2024
Machine learning accelerates pharmacophore-based virtual screening of MAO inhibitors
Marcin Cieślak, Tomasz Danel, Olga Krzysztyńska-Kuleta, et al.
IEEE Transactions on Neural Networks and Learning Systems
|
April 7, 2023
Feature-Based Interpolation and Geodesics in the Latent Spaces of Generative Models
Lukasz Struski, Michal Sadowski, Tomasz Danel, et al.
Journal of Chemical Information and Modeling
|
July 30, 2025
Qsarna: An Online Tool for Smart Chemical Space Navigation in Drug Design
Marcin Cieślak, Jan Łęski, Olga Krzysztyńska-Kuleta, et al.
Journal of Cheminformatics
|
January 12, 2021
Mol-CycleGAN: a generative model for molecular optimization
Łukasz Maziarka, Agnieszka Pocha, Jan Kaczmarczyk, et al.
Journal of Cheminformatics
|
January 4, 2024
Relative molecule self-attention transformer
Łukasz Maziarka, Dawid Majchrowski, Tomasz Danel, et al.
Page
of 2