Skip to main content
. 2020 Mar 28;25(7):1559. doi: 10.3390/molecules25071559

Table 6.

The parameters of “Apelblat model (A, B and C)” along with R2 and % RMSDs for ECT in various “PEG-400 + water” combinations (m) d.

m A B C R 2 RMSD (%) Overall RMSD (%)
0.0 −81.15 2029.00 12.20 0.9998 0.19
0.1 −234.90 9119.87 35.05 0.9994 0.67
0.2 −82.67 2184.81 12.46 0.9985 0.57
0.3 27.91 −2824.59 −3.95 0.9974 0.62
0.4 −109.75 3485.30 16.54 0.9996 0.28
0.5 −97.65 2968.30 14.77 0.9998 0.19 0.46
0.6 −84.07 2392.73 12.77 0.9985 0.48
0.7 −93.52 2872.33 14.19 0.9990 0.46
0.8 −61.36 1430.99 9.44 0.9991 0.36
0.9 24.32 −2380.72 −3.30 0.9975 0.60
1.0 −56.49 1285.38 8.76 0.9968 0.74

d The average relative uncertainties are u(A) = 0.92, u(B) = 1.54 and u(C) = 0.90.