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Correlation of experimental and calculated order parameters (S2) for several AMBER force fields.
| ff94 | ff99 | ff99SB | ff03 | |
|---|---|---|---|---|
|
|
||||
| lysozyme
|
||||
| RMSD | 0.11 | 0.12 | 0.06 | 0.13 |
| Ra | 0.61 | 0.62 | 0.83 | 0.62 |
|
| ||||
| ubiquitin
|
||||
| RMSD | 0.13 | 0.10 | 0.07 | 0.05 |
| R | 0.83 | 0.93 | 0.95 | 0.96 |
linear correlation coefficient
