ALDELE: All-Purpose Deep Learning Toolkits for Predicting theBiocatalytic Activities of Enzymes

ALDELE is an all-purpose deep-learning-based multiple-toolkit workflow for screening enzyme catalysts. ALDELE can predict the catalytic activities of enzymes, and particularly, it identifies residue-based hotspots to guide enzyme engineering and generates substrate heat maps to explore the substrate scope for a given biocatalyst. Moreover, our models notably match empirical data, reinforcing the practicality and reliability of our approach.