Table 2.
System | Atoms | Comp. Blocks | Diag. Blocks | Calc. E | Calc. HE | Calc. S | Diag. S | Calc. U | Propagate |
---|---|---|---|---|---|---|---|---|---|
Villin NLE | 582 | 103.4 | 189.5 | 4.0 | 67.8 | 3.9 | 12.9 | 3.4 | 37.1 |
BBL | 707 | 135.1 | 325.5 | 6.1 | 121.2 | 6.7 | 22.0 | 7.5 | 62.5 |
NTL9 | 881 | 122.8 | 224.4 | 11.6 | 200.4 | 10.5 | 51.6 | 13.3 | 85.9 |
Lambda Repressor | 1251 | 125.0 | 226.7 | 40.6 | 458.3 | 25.7 | 258.6 | 27.3 | 119.7 |