Table 3. Force Fields (FF), Total Production Run Times (t), and Temperatures (T) of All the Simulations.
peptide(s) | FF | t (μs) | T (K) |
---|---|---|---|
A7, P-113, P13, V1, V2, V3, V4, Pep3 | A | 5 | 300 |
A7, P13, V1, V2, V2.2, V3, V4, Pep3 | B | 5 | 300 |
A7, P-113, P13, V1, V2, V3, V4, Pep3 | C | 5 | 300 |
A7, P-113, P13, V1, V2, V3, V4, Pep3 | D | 5 | 300 |
P-113 | B | 12 | 300 |
Hst5 | A | 5 | 293 |
Hst5 | B | 7 | 293 |
Hst5 | C | 5 | 293 |
Hst5 | D | 5 | 293 |