STRUCTURAL PREDICTION OF FLEXIBLE COMPLEX OF PROTEINS
蛋白质柔性复合物的结构预测

Self consistent ensemble optimization (SCEO) method was applied to the situation considering flexible backbones to predict the three dimensional structure of interfaces of protein complexes. The approach simulates practically the "induced-fit process" in docking between protein receptor and ligand. It was applied successfully in 3 cases by taking account of both computational time and accuracy.