| Mol-CycleGAN: a generative model for molecular optimization Ł Maziarka, A Pocha, J Kaczmarczyk, K Rataj, T Danel, M Warchoł Journal of Cheminformatics 12 (1), 2, 2020 | 233 | 2020 |
| How can SHAP values help to shape metabolic stability of chemical compounds? A Wojtuch, R Jankowski, S Podlewska Journal of cheminformatics 13, 1-20, 2021 | 51 | 2021 |
| Emulating docking results using a deep neural network: a new perspective for virtual screening S Jastrzebski, M Szymczak, A Pocha, S Mordalski, J Tabor, AJ Bojarski, ... Journal of Chemical Information and Modeling 60 (9), 4246-4262, 2020 | 32 | 2020 |
| The importance of standardisation–COVID-19 CT & Radiograph Image Data Stock for deep learning purpose K Misztal, A Pocha, M Durak-Kozica, M Wątor, A Kubica-Misztal, M Hartel Computers in Biology and Medicine 127, 104092, 2020 | 13 | 2020 |
| Comparison of atom representations in graph neural networks for molecular property prediction A Pocha, T Danel, S Podlewska, J Tabor, Ł Maziarka 2021 International Joint Conference on Neural Networks (IJCNN), 1-8, 2021 | 8 | 2021 |
| Substructural connectivity fingerprint and extreme entropy machines—a new method of compound representation and analysis K Rataj, W Czarnecki, S Podlewska, A Pocha, AJ Bojarski Molecules 23 (6), 1242, 2018 | 7 | 2018 |
| Generation of new inhibitors of selected cytochrome P450 subtypes–In silico study T Danel, A Wojtuch, S Podlewska Computational and Structural Biotechnology Journal 20, 5639-5651, 2022 | 2 | 2022 |
| Extended study on atomic featurization in graph neural networks for molecular property prediction A Wojtuch, T Danel, S Podlewska, Ł Maziarka Journal of Cheminformatics 15 (1), 81, 2023 | 1 | 2023 |
| 2D SIFt: a matrix of ligand-receptor interactions S Mordalski, A Wojtuch, I Podolak, R Kurczab, AJ Bojarski Journal of Cheminformatics 13, 1-8, 2021 | | 2021 |
| SHAP-based tools for ADMET compounds profiling on the example of metabolic stability optimization A Wojtuch, R Jankowski, S Podlewska MDPI, 2021 | | 2021 |
| Optimization of Metabolic Stability of Ligands of Serotonin Receptor 5-HT7 Using SHAP Values A Wojtuch, R Jankowski, S Podlewska Biology and Life Sciences Forum 7 (1), 18, 2021 | | 2021 |
| Optimization of metabolic stability of ligands of serotonin receptor 5-HT7 using SHAP values A Pocha, R Jankowski, S Podlewska MDPI, 2021 | | 2021 |
| Short review of dimensionality reduction methods for failure detection A Pocha, K Misztal, P Morkisz Schedae Informaticae 26, 2017 | | 2017 |
| Głębokie uczenie konwolucyjnych sieci neuronowych dla problemów cheminformatycznych A Pocha | | 2015 |
| Optimization of Metabolic Stability of Ligands of Serotonin Receptor 5-HT7 Using SHAP Values. Biol A Wojtuch, R Jankowski, S Podlewska Life Sci. Forum, 0 | | |
| Generowanie zwiazków o poprawionej stabilnosci A Pocha, S Podlewska | | |
Sabina PodlewskaInstitute of Pharmacology Polish Academy of SciencesZweryfikowany adres z if-pan.krakow.pl
