Table 2.
| Force | Max Relative Difference |
|---|---|
| Harmonic bonds | 7.51·10−3 |
| Harmonic angles | 4.19·10−3 |
| Periodic torsions | 1.44·10−2 |
| Ryckaert-Bellemans torsions | 2.89·10−3 |
| Nonbonded (no cutoff) | 1.10·10−3 |
| Nonbonded (PME) | 3.89·10−3 |
| OBC implicit solvent | 6.18·10−4 |
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