Table 1. K_D (nM) of CR3022–RBD and 4A8–NTD Complexes Obtained by Experiments and Simulations.

complex	experiment results (KD)	our simulation results (KD)
4A8–NTD (PDB ID: 7C2L)	92.7 nM (Chi et al.)23	9.1 nM
CR3022–RBD (PDB ID: 6W41)	6.3 nM (Tian et al.)22	3.0 nM
	115.0 nM (Yuan et al.)21