| Project | RUN | System | Guest | Microstate | CLONE | Person | dG1 (kT) | dG1 sigma (kT) | dG3 (kT) | dG3 sigma (kT) | dG_binding (RT) | dG_binding sigma (RT) | log10Kd | log10Kd sigma | RL WL-increment | ns of RL simulation | Included |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 18433 | 57 | RL_12 | G7 | 1 | 0 | Steven | 6.42 | 0.0 | -15.61 | 2.22 | -12.72 | 2.22 | -5.52 | 0.97 | 0.0079 | 280.0 | True |
| 18433 | 57 | RL_12 | G7 | 1 | 1 | Steven | 6.42 | 0.0 | -14.86 | 1.43 | -12.08 | 1.44 | -5.24 | 0.63 | 0.0021 | 470.0 | True |
| 18433 | 57 | RL_12 | G7 | 1 | 2 | Steven | 6.42 | 0.0 | -14.69 | 1.61 | -11.96 | 1.62 | -5.19 | 0.70 | 0.0041 | 550.0 | True |
| 18433 | 57 | RL_12 | G7 | 1 | 3 | Steven | 6.42 | 0.0 | -14.36 | 2.79 | -11.56 | 2.80 | -5.02 | 1.21 | 0.0063 | 360.0 | True |
| 18433 | 57 | RL_12 | G7 | 1 | 4 | Steven | 6.42 | 0.0 | -14.93 | 2.52 | -12.07 | 2.52 | -5.24 | 1.10 | 0.0051 | 220.0 | True |
| 18433 | 57 | RL_12 | G7 | 1 | 5 | Steven | 6.42 | 0.0 | -14.37 | 2.69 | -11.56 | 2.69 | -5.02 | 1.17 | 0.0099 | 280.3 | True |
| 18433 | 57 | RL_12 | G7 | 1 | 6 | Steven | 6.42 | 0.0 | -13.65 | 3.34 | -10.86 | 3.35 | -4.72 | 1.45 | 0.0124 | 300.0 | True |
| 18433 | 57 | RL_12 | G7 | 1 | 7 | Steven | 6.42 | 0.0 | -15.44 | 1.83 | -12.74 | 1.84 | -5.53 | 0.80 | 0.0032 | 400.0 | True |
| 18433 | 57 | RL_12 | G7 | 1 | 8 | Steven | 6.42 | 0.0 | -14.61 | 2.07 | -11.87 | 2.08 | -5.16 | 0.90 | 0.0079 | 280.0 | True |
| 18433 | 57 | RL_12 | G7 | 1 | 9 | Steven | 6.42 | 0.0 | -15.63 | 1.92 | -12.76 | 1.93 | -5.54 | 0.84 | 0.0079 | 300.3 | True |
| 18433 | 57 | RL_12 | G7 | 1 | 10 | Steven | 6.42 | 0.0 | -14.63 | 3.07 | -11.90 | 3.08 | -5.17 | 1.34 | 0.0079 | 180.3 | True |
| 18433 | 57 | RL_12 | G7 | 1 | 11 | Steven | 6.42 | 0.0 | -15.74 | 1.92 | -13.02 | 1.92 | -5.65 | 0.84 | 0.0099 | 280.0 | True |
| 18433 | 57 | RL_12 | G7 | 1 | 12 | Steven | 6.42 | 0.0 | -15.25 | 2.01 | -12.41 | 2.01 | -5.39 | 0.87 | 0.0063 | 460.0 | True |
| 18433 | 57 | RL_12 | G7 | 1 | 13 | Steven | 6.42 | 0.0 | -15.20 | 1.80 | -12.45 | 1.81 | -5.41 | 0.78 | 0.0079 | 310.0 | True |
| 18433 | 57 | RL_12 | G7 | 1 | 14 | Steven | 6.42 | 0.0 | -14.69 | 1.56 | -11.83 | 1.57 | -5.14 | 0.68 | 0.0063 | 460.0 | True |
| 18433 | 57 | RL_12 | G7 | 1 | 15 | Steven | 6.42 | 0.0 | -15.72 | 2.37 | -12.94 | 2.38 | -5.62 | 1.03 | 0.0079 | 400.2 | True |
| 18433 | 57 | RL_12 | G7 | 1 | 16 | Steven | 6.42 | 0.0 | -15.26 | 2.51 | -12.48 | 2.52 | -5.42 | 1.09 | 0.0124 | 240.0 | True |
| 18433 | 57 | RL_12 | G7 | 1 | 17 | Steven | 6.42 | 0.0 | -14.22 | 3.20 | -11.54 | 3.21 | -5.01 | 1.40 | 0.0063 | 270.1 | True |
| 18433 | 57 | RL_12 | G7 | 1 | 18 | Steven | 6.42 | 0.0 | -15.46 | 2.29 | -12.64 | 2.29 | -5.49 | 1.00 | 0.0041 | 340.0 | True |
| 18433 | 57 | RL_12 | G7 | 1 | 19 | Steven | 6.42 | 0.0 | -15.62 | 1.82 | -12.84 | 1.83 | -5.58 | 0.80 | 0.0041 | 400.0 | True |
| 18433 | 57 | RL_12 | G7 | 1 | 20 | Steven | 6.42 | 0.0 | -14.39 | 2.53 | -11.59 | 2.54 | -5.03 | 1.10 | 0.0063 | 520.0 | True |
| 18433 | 57 | RL_12 | G7 | 1 | 21 | Steven | 6.42 | 0.0 | -15.68 | 2.22 | -12.93 | 2.23 | -5.61 | 0.97 | 0.0063 | 410.0 | True |
| 18433 | 57 | RL_12 | G7 | 1 | 22 | Steven | 6.42 | 0.0 | -14.75 | 1.80 | -12.00 | 1.81 | -5.21 | 0.79 | 0.0051 | 410.0 | True |
| 18433 | 57 | RL_12 | G7 | 1 | 23 | Steven | 6.42 | 0.0 | -15.33 | 2.00 | -12.59 | 2.01 | -5.47 | 0.87 | 0.0079 | 270.0 | True |
| 18433 | 57 | RL_12 | G7 | 1 | 24 | Steven | 6.42 | 0.0 | -14.26 | 2.23 | -11.42 | 2.24 | -4.96 | 0.97 | 0.0079 | 430.1 | True |
| 18433 | 57 | RL_12 | G7 | 1 | 25 | Steven | 6.42 | 0.0 | -14.80 | 1.64 | -11.97 | 1.65 | -5.20 | 0.72 | 0.0041 | 330.0 | True |
| 18433 | 57 | RL_12 | G7 | 1 | 26 | Steven | 6.42 | 0.0 | -15.21 | 1.72 | -12.31 | 1.75 | -5.35 | 0.76 | 0.0051 | 450.0 | True |
| 18433 | 57 | RL_12 | G7 | 1 | 27 | Steven | 6.42 | 0.0 | -14.96 | 2.22 | -12.25 | 2.23 | -5.32 | 0.97 | 0.0063 | 290.0 | True |
| 18433 | 57 | RL_12 | G7 | 1 | 28 | Steven | 6.42 | 0.0 | -15.27 | 1.75 | -12.47 | 1.77 | -5.42 | 0.77 | 0.0063 | 470.0 | True |
| 18433 | 57 | RL_12 | G7 | 1 | 29 | Steven | 6.42 | 0.0 | -14.49 | 2.81 | -11.75 | 2.81 | -5.10 | 1.22 | 0.0051 | 360.0 | True |
| 18433 | 57 | RL_12 | G7 | 1 | 30 | Steven | 6.42 | 0.0 | -13.72 | 6.04 | -11.01 | 6.04 | -4.78 | 2.62 | 0.0378 | 90.0 | True |
| 18433 | 57 | RL_12 | G7 | 1 | 31 | Steven | 6.42 | 0.0 | -15.21 | 1.87 | -12.48 | 1.87 | -5.42 | 0.81 | 0.0051 | 300.0 | True |
| 18433 | 57 | RL_12 | G7 | 1 | 32 | Steven | 6.42 | 0.0 | -14.47 | 2.00 | -11.71 | 2.00 | -5.09 | 0.87 | 0.0063 | 390.0 | True |
| 18433 | 57 | RL_12 | G7 | 1 | 33 | Steven | 6.42 | 0.0 | -15.15 | 1.89 | -12.37 | 1.90 | -5.37 | 0.82 | 0.0063 | 290.4 | True |
| 18433 | 57 | RL_12 | G7 | 1 | 34 | Steven | 6.42 | 0.0 | -14.60 | 2.30 | -11.74 | 2.30 | -5.10 | 1.00 | 0.0124 | 350.0 | True |
| 18433 | 57 | RL_12 | G7 | 1 | 35 | Steven | 6.42 | 0.0 | -14.36 | 1.94 | -11.50 | 1.95 | -5.00 | 0.85 | 0.0063 | 370.0 | True |
| 18433 | 57 | RL_12 | G7 | 1 | 36 | Steven | 6.42 | 0.0 | -14.79 | 1.86 | -12.01 | 1.86 | -5.22 | 0.81 | 0.0063 | 360.0 | True |
| 18433 | 57 | RL_12 | G7 | 1 | 37 | Steven | 6.42 | 0.0 | -14.77 | 2.44 | -11.97 | 2.44 | -5.20 | 1.06 | 0.0041 | 380.0 | True |
| 18433 | 57 | RL_12 | G7 | 1 | 38 | Steven | 6.42 | 0.0 | -14.82 | 2.20 | -12.05 | 2.20 | -5.23 | 0.96 | 0.0051 | 390.3 | True |
| 18433 | 57 | RL_12 | G7 | 1 | 39 | Steven | 6.42 | 0.0 | -15.20 | 1.94 | -12.45 | 1.95 | -5.41 | 0.85 | 0.0041 | 300.0 | True |
| 18433 | 57 | RL_12 | G7 | 1 | 40 | Steven | 6.42 | 0.0 | -15.19 | 1.55 | -12.36 | 1.55 | -5.37 | 0.67 | 0.0041 | 470.2 | True |
| 18433 | 57 | RL_12 | G7 | 1 | 41 | Steven | 6.42 | 0.0 | -14.99 | 1.94 | -12.23 | 1.95 | -5.31 | 0.85 | 0.0063 | 440.0 | True |
| 18433 | 57 | RL_12 | G7 | 1 | 42 | Steven | 6.42 | 0.0 | -14.67 | 2.50 | -11.99 | 2.51 | -5.21 | 1.09 | 0.0099 | 290.0 | True |
| 18433 | 57 | RL_12 | G7 | 1 | 43 | Steven | 6.42 | 0.0 | -14.71 | 1.85 | -11.96 | 1.85 | -5.20 | 0.80 | 0.0063 | 270.1 | True |
| 18433 | 57 | RL_12 | G7 | 1 | 44 | Steven | 6.42 | 0.0 | -14.37 | 2.52 | -11.65 | 2.52 | -5.06 | 1.10 | 0.0099 | 280.0 | True |
| 18433 | 57 | RL_12 | G7 | 1 | 45 | Steven | 6.42 | 0.0 | -14.44 | 2.12 | -11.65 | 2.13 | -5.06 | 0.92 | 0.0063 | 290.0 | True |
| 18433 | 57 | RL_12 | G7 | 1 | 46 | Steven | 6.42 | 0.0 | -14.61 | 2.26 | -11.83 | 2.26 | -5.14 | 0.98 | 0.0124 | 330.0 | True |
| 18433 | 57 | RL_12 | G7 | 1 | 47 | Steven | 6.42 | 0.0 | -14.72 | 2.19 | -11.97 | 2.20 | -5.20 | 0.95 | 0.0124 | 410.0 | True |
| 18433 | 57 | RL_12 | G7 | 1 | 48 | Steven | 6.42 | 0.0 | -15.05 | 2.45 | -12.15 | 2.46 | -5.28 | 1.07 | 0.0079 | 250.25 | True |
| 18433 | 57 | RL_12 | G7 | 1 | 49 | Steven | 6.42 | 0.0 | -15.25 | 2.01 | -12.46 | 2.02 | -5.41 | 0.88 | 0.0079 | 330.0 | True |
| Project | RUN | System | Guest | Microstate | CLONE | Person | dG2 (kT) | dG2 sigma (kT) | L WL-increment | ns of L simulation | Included |
|---|---|---|---|---|---|---|---|---|---|---|---|
| 18434 | 13 | L | G7 | 1 | 0 | Steven | -3.53 | 0.17 | 0.0000 | 169.15 | True |
| 18434 | 13 | L | G7 | 1 | 1 | Steven | -3.63 | 0.18 | 0.0002 | 140.3 | True |
| 18434 | 13 | L | G7 | 1 | 2 | Steven | -3.69 | 0.16 | 0.0002 | 120.0 | True |
| 18434 | 13 | L | G7 | 1 | 3 | Steven | -3.61 | 0.14 | 0.0000 | 217.5 | True |
| 18434 | 13 | L | G7 | 1 | 4 | Steven | -3.55 | 0.12 | 0.0000 | 273.4 | True |
| 18434 | 13 | L | G7 | 1 | 5 | Steven | -3.60 | 0.15 | 0.0000 | 218.45 | True |
| 18434 | 13 | L | G7 | 1 | 6 | Steven | -3.63 | 0.18 | 0.0000 | 210.3 | True |
| 18434 | 13 | L | G7 | 1 | 7 | Steven | -3.71 | 0.21 | 0.0000 | 170.0 | True |
| 18434 | 13 | L | G7 | 1 | 8 | Steven | -3.68 | 0.19 | 0.0000 | 190.25 | True |
| 18434 | 13 | L | G7 | 1 | 9 | Steven | -3.55 | 0.18 | 0.0000 | 212.65 | True |
| 18434 | 13 | L | G7 | 1 | 10 | Steven | -3.68 | 0.16 | 0.0000 | 254.35 | True |
| 18434 | 13 | L | G7 | 1 | 11 | Steven | -3.69 | 0.18 | 0.0001 | 170.0 | True |
| 18434 | 13 | L | G7 | 1 | 12 | Steven | -3.58 | 0.19 | 0.0000 | 180.15 | True |
| 18434 | 13 | L | G7 | 1 | 13 | Steven | -3.66 | 0.16 | 0.0000 | 207.8 | True |
| 18434 | 13 | L | G7 | 1 | 14 | Steven | -3.56 | 0.16 | 0.0000 | 205.8 | True |
| 18434 | 13 | L | G7 | 1 | 15 | Steven | -3.63 | 0.13 | 0.0000 | 197.3 | True |
| 18434 | 13 | L | G7 | 1 | 16 | Steven | -3.64 | 0.14 | 0.0000 | 254.25 | True |
| 18434 | 13 | L | G7 | 1 | 17 | Steven | -3.73 | 0.25 | 0.0017 | 90.0 | True |
| 18434 | 13 | L | G7 | 1 | 18 | Steven | -3.59 | 0.13 | 0.0000 | 204.25 | True |
| 18434 | 13 | L | G7 | 1 | 19 | Steven | -3.64 | 0.19 | 0.0001 | 160.0 | True |
| 18434 | 13 | L | G7 | 1 | 20 | Steven | -3.61 | 0.20 | 0.0001 | 140.0 | True |
| 18434 | 13 | L | G7 | 1 | 21 | Steven | -3.66 | 0.15 | 0.0000 | 200.15 | True |
| 18434 | 13 | L | G7 | 1 | 22 | Steven | -3.67 | 0.19 | 0.0000 | 160.0 | True |
| 18434 | 13 | L | G7 | 1 | 23 | Steven | -3.68 | 0.15 | 0.0000 | 228.05 | True |
| 18434 | 13 | L | G7 | 1 | 24 | Steven | -3.57 | 0.15 | 0.0000 | 211.65 | True |
| 18434 | 13 | L | G7 | 1 | 25 | Steven | -3.59 | 0.20 | 0.0000 | 140.0 | True |
| 18434 | 13 | L | G7 | 1 | 26 | Steven | -3.52 | 0.30 | 0.0001 | 160.3 | True |
| 18434 | 13 | L | G7 | 1 | 27 | Steven | -3.70 | 0.14 | 0.0000 | 199.85 | True |
| 18434 | 13 | L | G7 | 1 | 28 | Steven | -3.62 | 0.22 | 0.0000 | 226.1 | True |
| 18434 | 13 | L | G7 | 1 | 29 | Steven | -3.68 | 0.15 | 0.0000 | 194.2 | True |
| 18434 | 13 | L | G7 | 1 | 30 | Steven | -3.71 | 0.12 | 0.0000 | 273.0 | True |
| 18434 | 13 | L | G7 | 1 | 31 | Steven | -3.68 | 0.11 | 0.0000 | 222.3 | True |
| 18434 | 13 | L | G7 | 1 | 32 | Steven | -3.66 | 0.15 | 0.0000 | 227.85 | True |
| 18434 | 13 | L | G7 | 1 | 33 | Steven | -3.63 | 0.14 | 0.0000 | 226.45 | True |
| 18434 | 13 | L | G7 | 1 | 34 | Steven | -3.55 | 0.18 | 0.0000 | 218.8 | True |
| 18434 | 13 | L | G7 | 1 | 35 | Steven | -3.56 | 0.14 | 0.0000 | 188.8 | True |
| 18434 | 13 | L | G7 | 1 | 36 | Steven | -3.64 | 0.16 | 0.0001 | 150.0 | True |
| 18434 | 13 | L | G7 | 1 | 37 | Steven | -3.62 | 0.15 | 0.0000 | 199.45 | True |
| 18434 | 13 | L | G7 | 1 | 38 | Steven | -3.64 | 0.14 | 0.0000 | 180.0 | True |
| 18434 | 13 | L | G7 | 1 | 39 | Steven | -3.66 | 0.17 | 0.0000 | 208.35 | True |
| 18434 | 13 | L | G7 | 1 | 40 | Steven | -3.59 | 0.12 | 0.0000 | 228.85 | True |
| 18434 | 13 | L | G7 | 1 | 41 | Steven | -3.65 | 0.20 | 0.0000 | 190.0 | True |
| 18434 | 13 | L | G7 | 1 | 42 | Steven | -3.73 | 0.25 | 0.0009 | 90.05 | True |
| 18434 | 13 | L | G7 | 1 | 43 | Steven | -3.67 | 0.15 | 0.0000 | 197.5 | True |
| 18434 | 13 | L | G7 | 1 | 44 | Steven | -3.69 | 0.14 | 0.0000 | 174.4 | True |
| 18434 | 13 | L | G7 | 1 | 45 | Steven | -3.62 | 0.14 | 0.0000 | 210.0 | True |
| 18434 | 13 | L | G7 | 1 | 46 | Steven | -3.64 | 0.12 | 0.0000 | 180.15 | True |
| 18434 | 13 | L | G7 | 1 | 47 | Steven | -3.66 | 0.13 | 0.0000 | 253.45 | True |
| 18434 | 13 | L | G7 | 1 | 48 | Steven | -3.52 | 0.16 | 0.0000 | 180.0 | True |
| 18434 | 13 | L | G7 | 1 | 49 | Steven | -3.62 | 0.13 | 0.0000 | 250.85 | True |