Table 2. Populations of CFF binding poses (%) detected across systems I-III over the last 400 ns of MD simulated time.
| BP Index | I | II | III |
|---|---|---|---|
| A | 38.1 | - | |
| B | - | 29.1 | - |
| C | 31.9 | 5.8 | 92.4 |
| D | - | - | 3.8 |
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