TABLE 5.
Basepairs | % GC | Topology | Total energy (kcal/mol) | Predicted energy (kcal/mol) | Difference (kcal/mol) | % Difference |
---|---|---|---|---|---|---|
70 | 42.85 | B-DNA | −27436.04 | −27115.8 | −320.27 | 1.17 |
86 | 44.18 | A-DNA | −33251.41 | −33387.9 | 136.51 | 0.41 |
92 | 39.13 | B-DNA | −31920.4 | −32112.5 | 192.08 | 0.6 |
98 | 48.97 | Z-DNA | −33057.76 | −33039 | −18.8 | 0.06 |