Table 1. Summary of the principal simulations.
Simulation | Description | Duration |
tal-sol-AT | talin in water; AT-MD | 2×0.1 µs |
tal-h2F0-CG | talin association with an anionic bilayer; CG-MD | 5×1.5 µs |
tal-h2F0-AT | talin association with an anionic bilayer; AT-MD | 3×45 |
αβ-talh2-CG | αβ TM + talin in a bilayer; CG-MD | 5×4 µs |
αβ-talh2o-AT | αβ TM + talin in a bilayer; AT-MD | 1.0 µs |