化合物 | 范德华力 | 静电势能 | 极性溶剂化作用 | 表面溶剂化作用 | 结合自由能 |
M1 | −170.639 ± 0.577 | −51.028 ± 0.299 | 65.182 ± 0.672 | −19.216 ± 0.059 | −175.701 ± 0.724 |
M2 | −216.047 ± 0.922 | −60.328 ± 0.922 | 160.319 ± 0.802 | −22.779 ± 0.056 | −138.828 ± 1.049 |