Table 4.

Analysis of hydrogen bond numbers for guests C7, C8 and C10. The number of hydrogen bonds between guest-water in solution and between guest-host/water in host-guest complex are listed as N_solution and N_complex respectively. Further decompositions of hydrogen bond numbers between guest-host, and between guest-water in host-guest complex are given in $N_{\mathit{complex}}^{g-h}$ and $N_{\mathit{complex}}^{w-h}$. The presenting hydrogen bond numbers are averaged by 1000 frames over 1 ns.

Guest	Nsolution	Ncomplex	$N_{\mathit{complex}}^{g-h}$	$N_{\mathit{complex}}^{g-w}$
C7	2.690	3.554	1.617	1.937
C8	2.792	3.389	1.201	2.188
C10	5.709	5.452	1.325	4.127