Sequeiros-Borja C, Škoda P, Brezovsky J, 2026: Toward Automatic Derivation of Geometry-Based Descriptors as Surrogates for Complex Computational Approaches in Enzyme–Substrate Prediction. ChemPhysChem 27: e202500883. full text dataset Accurate prediction of enzyme–substrate (ES) interactions remains a fundamental challenge in biocatalysis … Continue reading New publication in ChemPhysChem