SCREEN: a graph-based contrastive learning tool to infer catalytic residues and assess mutation tolerance in enzymes
Tong Pan, Yue Bi, Xiaoyu Wang, Ying Zhang, Geoffrey I. Webb, Robin B. Gasser, Lukasz Kurgan, Jiangning Song
SCREEN is a graph neural network that predicts catalytic residues and assesses mutation tolerance in enzymes by integrating structural and functional information.
bioRxiv · Jun 27, 2024 · PreprintBioinformatics