dr Agnieszka Wojtuch

Jednostki:

  • Wydział Matematyki i Informatyki UJ
  • Instytut Informatyki i Matematyki Komputerowej
  • Katedra Uczenia Maszynowego

Doktorat  Otwarcie: 2018-09-27, Zamknięcie: 2024-12-19

Publikacje:

10.
Agnieszka Wojtuch, Tomasz Danel, Sabina Podlewska, Łukasz Maziarka
Extended study on atomic featurization in graph neural networks for molecular property prediction, Journal of Cheminformatics (2023),
9.
Tomasz Danel, Agnieszka Wojtuch, Sabina Podlewska
Generation of new inhibitors of selected cytochrome P450 subtypes – in silico study, Computational and Structural Biotechnology Journal (2022),
8.
Rafał Jankowski, Sabina Podlewska, Agnieszka Wojtuch
How can SHAP values shape the metabolic stability?, Journal of Cheminformatics vol. 13 (2021), Article number: 74
7.
Andrzej Bojarski, Rafał Kurczab, Stefan Mordalski, Igor Podolak, Agnieszka Wojtuch
2D SIFt: a matrix of ligand-receptor interactions, Journal of Cheminformatics vol. 13 (2021), Article number: 66
6.
Tomasz Danel, Łukasz Maziarka, Sabina Podlewska, Jacek Tabor, Agnieszka Wojtuch
Comparison of Atom Representations in Graph Neural Networks for Molecular Property Prediction, IEEE International Joint Conference on Neural Networks [IJCNN], (2021), 1-8
5.
Andrzej Bojarski, Stanisław Jastrzębski, Stefan Mordalski, Sabina Podlewska, Maciej Szymczak, Jacek Tabor, Agnieszka Wojtuch
Emulating docking results using a deep neural network: a new perspective for virtual screening, Journal of Chemical Information and Modeling (2020), 4246-4262
4.
Kubica-Misztal Aleksandra , Martyna Durak-Kozica, Marcin Hartel, Krzysztof Misztal, Michał Wątor, Agnieszka Wojtuch
The importance of standardisation – COVID-19 CT & Radiograph Image Data Stock for deep learning purpose, Computers in Biology and Medicine vol. 127 (2020), 104092
3.
Andrzej Bojarski, Stanisław Jastrzębski, Stefan Mordalski, Sabina Podlewska, Maciej Szymczak, Jacek Tabor, Agnieszka Wojtuch
Emulating Docking Results Using a Deep Neural Network: A New Perspective for Virtual Screening, Journal of Chemical Information and Modeling vol. 60 (2020), 4246-4262
2.
Tomasz Danel, Jan Kaczmarczyk, Łukasz Maziarka, Krzysztof Rataj, Michał Warchoł, Agnieszka Wojtuch
Mol-CycleGAN: a generative model for molecular optimization, Journal of Cheminformatics vol. 12 (2020),
1.
Jan Kaczmarczyk, Łukasz Maziarka, Krzysztof Rataj, Michał Warchoł, Agnieszka Wojtuch
Mol-CycleGAN - A Generative Model for Molecular Optimization, Artificial Neural Networks and Machine Learning – Icann 2019: Workshop and Special Sessions (2019), 810-816

Konferencje:

4.
Agnieszka Wojtuch, Tomasz Danel, Konrad Walkowicz.
34th Conference on Neural Information Processing Systems [NeurIPS 2020], Neural Information Processing Systems Foundation, [virtual], [virtual], 2020-12-06 - 2020-12-12
3.
Agnieszka Wojtuch.
Eastern European Machine Learning Summer School 2020, EEML, Kraków (virtual conference), Polska, 2020-07-01 - 2020-07-09
2.
Agnieszka Wojtuch.
Eastern European Machine Learning Summer School, D. Precup, R. Pascanu, V. Patraucean, E. Burceanu, G. Marchidan, M. Leordeanu, T. Rebedea, Bukareszt, Rumunia, 2019-07-01 - 2019-07-06
1.
Marek Śmieja, Łukasz Struski, Agnieszka Wojtuch, Łukasz Maziarka, Tomasz Danel.
TFML 3rd International Conference on Theoretical Foundations of Machine Learning, Uniwersytet Jagielloński, Kraków, Polska, 2019-02-11 - 2019-02-15