GlyLES: Grammar-based Parsing of Glycans from IUPAC-condensed to SMILES R Joeres, D Bojar, OV Kalinina Journal of Cheminformatics 15 (1), 37, 2023 | 6 | 2023 |
DataSAIL: Data Splitting Against Information Leakage R Joeres, DB Blumenthal, OV Kalinina bioRxiv, 2023.11. 15.566305, 2023 | 5 | 2023 |
Multiple sequence alignment using deep reinforcement learning R Joeres Gesellschaft für Informatik, Bonn, 2021 | 4 | 2021 |
TeachOpenCADD goes Deep Learning: Open-source Teaching Platform Exploring Molecular DL Applications M Backenköhler, PL Kramer, J Groß, G Großmann, R Joeres, ... | 3 | 2023 |
Higher-Order Message Passing for Glycan Representation Learning R Joeres, D Bojar arXiv preprint arXiv:2409.13467, 2024 | | 2024 |
Navigating the maze of mass spectra: a machine-learning guide to identifying diagnostic ions in O-glycan analysis J Urban, R Joeres, L Thomès, KA Thomsson, D Bojar Analytical and Bioanalytical Chemistry, 1-13, 2024 | | 2024 |
Guiding questions to avoid data leakage in biological machine learning applications J Bernett, DB Blumenthal, DG Grimm, F Haselbeck, R Joeres, OV Kalinina, ... Nature Methods 21 (8), 1444-1453, 2024 | | 2024 |