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Simulation Details for the Different Models of EGF
| System | MD (ns) |
Sim. size (atoms) |
No. of DIMS transitions |
Computing resource |
|---|---|---|---|---|
| d-sym | 20 | 138,000 | 201 | TACC-Lonestar |
| d-asym | 20 | 115,000 | 202 | TACC-Lonestar |
| h-sym | 36 | 123,000 | 198 | NICS-Kraken/TACC-Lonestar |
| h-asym | 36 | 137,000 | 200 | NICS-Kraken/TACC-Lonestar |
| h2-sym | 34 | 142,000 | 201 | NICS-Kraken/TACC-Lonestar |
| h2-asym | 34 | 149,000 | 204 | NICS-Kraken/TACC-Lonestar |
