Table 3. Vibrational Entropy Change upon Looping of 107-bp DNA Duplex T(Scir–Slin) at T = 300 K in Units of kcal·mol–1.
| total | average per bp | |
|---|---|---|
| continuum model estimate | –21 | –0.20 |
| atomistic model estimate | 805 ± 445 | 7.50 ± 4.15 |
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