Table 1.
Number of molecules in Molecular Dynamics simulations.
| Molecules | Solvent | ||||
|---|---|---|---|---|---|
| Water | 3 M GdmCl | 6 M GdmCl | 4 M Urea | 8 M Urea | |
| SPC water | 1438 | 1085 | 776 | 1148 | 727 |
| Gdm+ | - | 82 | 137 | - | - |
| Urea | - | - | - | 110 | 160 |
| Na+ | 3 | 3 | 3 | 3 | 3 |
| Cl- | 1 | 83 | 138 | 1 | 1 |
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