3 papers
cs.LG2026
When should we trust the annotation? Selective prediction for molecular structure retrieval from mass spectra
Mira Jürgens, Mira Jürgens, Gaetan De Waele +2
Machine learning methods for identifying molecular structures from tandem mass spectra (MS/MS) have advanced rapidly, yet current approaches still exhibit significant error rates.…
cs.CL2025
A Language Model-Driven Semi-Supervised Ensemble Framework for Illicit Market Detection Across Deep/Dark Web and Social Platforms
Navid Yazdanjue, Morteza Rakhshaninejad, Hossein Yazdanjouei +4
Illegal marketplaces have increasingly shifted to concealed parts of the internet, including the deep and dark web, as well as platforms such as Telegram, Reddit, and Pastebin. The…
cs.LG2025
Conformal Prediction for Uncertainty Estimation in Drug-Target Interaction Prediction
Morteza Rakhshaninejad, Mira Jurgens, Nicolas Dewolf +1
Accurate drug-target interaction (DTI) prediction with machine learning models is essential for drug discovery. Such models should also provide a credible representation of their u…