2 papers
cs.LG2026
Co-Evolution-Based Metal-Binding Residue Prediction with Graph Neural Networks
Sayedmohammadreza Rastegari, Sina Tabakhi, Xianyuan Liu +3
Understanding protein-metal interactions is central to structural biology, with metal ions being vital for catalysis, stability, and signal transduction. Predicting metal-binding r…
q-bio.QM2025
Interpretable Multimodal Learning for Tumor Protein-Metal Binding: Progress, Challenges, and Perspectives
Xiaokun Liu, Sayedmohammadreza Rastegari, Yijun Huang +12
In cancer therapeutics, protein-metal binding mechanisms critically govern the pharmacokinetics and targeting efficacy of drugs, thereby fundamentally shaping the rational design o…