| 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 | 18 | RL_8 | G11 | 1 | 0 | Julie | 6.42 | 0.0 | -104.52 | 1.97 | -14.64 | 2.06 | -6.36 | 0.90 | 0.0124 | 250.0 | True |
| 18433 | 18 | RL_8 | G11 | 1 | 1 | Julie | 6.42 | 0.0 | -104.57 | 1.60 | -14.42 | 1.63 | -6.26 | 0.71 | 0.0063 | 390.0 | True |
| 18433 | 18 | RL_8 | G11 | 1 | 2 | Julie | 6.42 | 0.0 | -104.62 | 1.89 | -14.48 | 1.90 | -6.29 | 0.83 | 0.0079 | 520.0 | True |
| 18433 | 18 | RL_8 | G11 | 1 | 3 | Julie | 6.42 | 0.0 | -104.04 | 1.78 | -13.90 | 1.80 | -6.04 | 0.78 | 0.0099 | 320.0 | True |
| 18433 | 18 | RL_8 | G11 | 1 | 4 | Julie | 6.42 | 0.0 | -104.50 | 2.36 | -14.25 | 2.38 | -6.19 | 1.03 | 0.0079 | 190.0 | True |
| 18433 | 18 | RL_8 | G11 | 1 | 5 | Julie | 6.42 | 0.0 | -104.12 | 1.82 | -13.88 | 1.84 | -6.03 | 0.80 | 0.0099 | 420.3 | True |
| 18433 | 18 | RL_8 | G11 | 1 | 6 | Julie | 6.42 | 0.0 | -104.13 | 1.79 | -13.99 | 1.81 | -6.08 | 0.79 | 0.0063 | 580.15 | True |
| 18433 | 18 | RL_8 | G11 | 1 | 7 | Julie | 6.42 | 0.0 | -104.20 | 2.06 | -13.99 | 2.07 | -6.08 | 0.90 | 0.0079 | 340.0 | True |
| 18433 | 18 | RL_8 | G11 | 1 | 8 | Julie | 6.42 | 0.0 | -104.00 | 1.68 | -13.79 | 1.70 | -5.99 | 0.74 | 0.0099 | 370.1 | True |
| 18433 | 18 | RL_8 | G11 | 1 | 9 | Julie | 6.42 | 0.0 | -104.31 | 2.59 | -14.16 | 2.60 | -6.15 | 1.13 | 0.0099 | 400.0 | True |
| 18433 | 18 | RL_8 | G11 | 1 | 10 | Julie | 6.42 | 0.0 | -104.04 | 1.90 | -13.71 | 1.91 | -5.95 | 0.83 | 0.0155 | 250.0 | True |
| 18433 | 18 | RL_8 | G11 | 1 | 11 | Julie | 6.42 | 0.0 | -104.16 | 1.92 | -13.96 | 1.95 | -6.06 | 0.84 | 0.0099 | 410.0 | True |
| 18433 | 18 | RL_8 | G11 | 1 | 12 | Julie | 6.42 | 0.0 | -104.17 | 2.22 | -14.00 | 2.23 | -6.08 | 0.97 | 0.0079 | 510.0 | True |
| 18433 | 18 | RL_8 | G11 | 1 | 13 | Julie | 6.42 | 0.0 | -104.34 | 2.06 | -14.14 | 2.07 | -6.14 | 0.90 | 0.0063 | 440.0 | True |
| 18433 | 18 | RL_8 | G11 | 1 | 14 | Julie | 6.42 | 0.0 | -104.18 | 1.96 | -14.08 | 1.97 | -6.11 | 0.86 | 0.0051 | 370.0 | True |
| 18433 | 18 | RL_8 | G11 | 1 | 15 | Julie | 6.42 | 0.0 | -104.59 | 1.82 | -14.30 | 1.84 | -6.21 | 0.80 | 0.0079 | 410.0 | True |
| 18433 | 18 | RL_8 | G11 | 1 | 16 | Julie | 6.42 | 0.0 | -103.77 | 2.34 | -13.58 | 2.35 | -5.90 | 1.02 | 0.0124 | 210.0 | True |
| 18433 | 18 | RL_8 | G11 | 1 | 17 | Julie | 6.42 | 0.0 | -102.77 | 3.25 | -12.62 | 3.26 | -5.48 | 1.42 | 0.0242 | 240.0 | False |
| 18433 | 18 | RL_8 | G11 | 1 | 18 | Julie | 6.42 | 0.0 | -104.30 | 1.87 | -14.13 | 1.88 | -6.14 | 0.82 | 0.0099 | 260.0 | True |
| 18433 | 18 | RL_8 | G11 | 1 | 19 | Julie | 6.42 | 0.0 | -104.73 | 1.91 | -14.60 | 1.92 | -6.34 | 0.84 | 0.0099 | 230.0 | True |
| 18433 | 18 | RL_8 | G11 | 1 | 20 | Julie | 6.42 | 0.0 | -105.11 | 2.63 | -14.90 | 2.64 | -6.47 | 1.14 | 0.0378 | 60.0 | False |
| 18433 | 18 | RL_8 | G11 | 1 | 21 | Julie | 6.42 | 0.0 | -104.08 | 2.16 | -13.86 | 2.18 | -6.02 | 0.95 | 0.0099 | 270.0 | True |
| 18433 | 18 | RL_8 | G11 | 1 | 22 | Julie | 6.42 | 0.0 | -104.00 | 1.77 | -13.71 | 1.80 | -5.96 | 0.78 | 0.0063 | 350.3 | True |
| 18433 | 18 | RL_8 | G11 | 1 | 23 | Julie | 6.42 | 0.0 | -103.93 | 2.09 | -13.85 | 2.10 | -6.01 | 0.91 | 0.0099 | 360.0 | True |
| 18433 | 18 | RL_8 | G11 | 1 | 24 | Julie | 6.42 | 0.0 | -104.65 | 1.96 | -14.35 | 1.97 | -6.23 | 0.86 | 0.0124 | 180.0 | True |
| 18433 | 18 | RL_8 | G11 | 1 | 25 | Julie | 6.42 | 0.0 | -104.04 | 2.01 | -13.88 | 2.03 | -6.03 | 0.88 | 0.0063 | 390.0 | True |
| 18433 | 18 | RL_8 | G11 | 1 | 26 | Julie | 6.42 | 0.0 | -104.67 | 2.05 | -14.52 | 2.06 | -6.31 | 0.90 | 0.0099 | 300.0 | True |
| 18433 | 18 | RL_8 | G11 | 1 | 27 | Julie | 6.42 | 0.0 | -104.32 | 1.86 | -14.01 | 1.90 | -6.08 | 0.82 | 0.0063 | 490.0 | True |
| 18433 | 18 | RL_8 | G11 | 1 | 28 | Julie | 6.42 | 0.0 | -104.05 | 1.98 | -13.77 | 1.99 | -5.98 | 0.86 | 0.0079 | 450.1 | True |
| 18433 | 18 | RL_8 | G11 | 1 | 29 | Julie | 6.42 | 0.0 | -104.02 | 2.14 | -13.85 | 2.18 | -6.01 | 0.95 | 0.0099 | 430.0 | True |
| 18433 | 18 | RL_8 | G11 | 1 | 30 | Julie | 6.42 | 0.0 | -104.36 | 2.34 | -14.06 | 2.35 | -6.11 | 1.02 | 0.0155 | 260.2 | True |
| 18433 | 18 | RL_8 | G11 | 1 | 31 | Julie | 6.42 | 0.0 | -104.12 | 2.31 | -13.98 | 2.32 | -6.07 | 1.01 | 0.0155 | 170.0 | True |
| 18433 | 18 | RL_8 | G11 | 1 | 32 | Julie | 6.42 | 0.0 | -104.19 | 1.95 | -13.97 | 1.97 | -6.07 | 0.85 | 0.0051 | 440.0 | True |
| 18433 | 18 | RL_8 | G11 | 1 | 33 | Julie | 6.42 | 0.0 | -104.51 | 1.75 | -14.26 | 1.76 | -6.19 | 0.76 | 0.0099 | 270.0 | True |
| 18433 | 18 | RL_8 | G11 | 1 | 34 | Julie | 6.42 | 0.0 | -104.81 | 2.44 | -14.57 | 2.45 | -6.33 | 1.06 | 0.0124 | 230.0 | True |
| 18433 | 18 | RL_8 | G11 | 1 | 35 | Julie | 6.42 | 0.0 | -104.19 | 1.62 | -13.96 | 1.63 | -6.06 | 0.71 | 0.0079 | 430.0 | True |
| 18433 | 18 | RL_8 | G11 | 1 | 36 | Julie | 6.42 | 0.0 | -104.31 | 1.86 | -14.02 | 1.87 | -6.09 | 0.81 | 0.0099 | 320.0 | True |
| 18433 | 18 | RL_8 | G11 | 1 | 37 | Julie | 6.42 | 0.0 | -103.83 | 1.75 | -13.50 | 1.79 | -5.86 | 0.78 | 0.0079 | 390.0 | True |
| 18433 | 18 | RL_8 | G11 | 1 | 38 | Julie | 6.42 | 0.0 | -104.05 | 1.88 | -13.91 | 1.92 | -6.04 | 0.83 | 0.0079 | 370.0 | True |
| 18433 | 18 | RL_8 | G11 | 1 | 39 | Julie | 6.42 | 0.0 | -104.49 | 1.51 | -14.25 | 1.53 | -6.19 | 0.66 | 0.0063 | 340.0 | True |
| 18433 | 18 | RL_8 | G11 | 1 | 40 | Julie | 6.42 | 0.0 | -104.75 | 1.66 | -14.54 | 1.68 | -6.32 | 0.73 | 0.0079 | 260.0 | True |
| 18433 | 18 | RL_8 | G11 | 1 | 41 | Julie | 6.42 | 0.0 | -104.25 | 1.85 | -14.12 | 1.86 | -6.13 | 0.81 | 0.0063 | 280.1 | True |
| 18433 | 18 | RL_8 | G11 | 1 | 42 | Julie | 6.42 | 0.0 | -104.13 | 2.03 | -13.82 | 2.05 | -6.00 | 0.89 | 0.0079 | 280.0 | True |
| 18433 | 18 | RL_8 | G11 | 1 | 43 | Julie | 6.42 | 0.0 | -103.82 | 1.61 | -13.76 | 1.62 | -5.98 | 0.71 | 0.0051 | 450.0 | True |
| 18433 | 18 | RL_8 | G11 | 1 | 44 | Julie | 6.42 | 0.0 | -104.43 | 2.09 | -14.25 | 2.10 | -6.19 | 0.91 | 0.0063 | 410.0 | True |
| 18433 | 18 | RL_8 | G11 | 1 | 45 | Julie | 6.42 | 0.0 | -104.40 | 1.83 | -14.23 | 1.85 | -6.18 | 0.80 | 0.0079 | 550.05 | True |
| 18433 | 18 | RL_8 | G11 | 1 | 46 | Julie | 6.42 | 0.0 | -103.84 | 1.84 | -13.63 | 1.85 | -5.92 | 0.80 | 0.0099 | 300.0 | True |
| 18433 | 18 | RL_8 | G11 | 1 | 47 | Julie | 6.42 | 0.0 | -104.40 | 1.97 | -14.16 | 1.99 | -6.15 | 0.86 | 0.0099 | 430.0 | True |
| 18433 | 18 | RL_8 | G11 | 1 | 48 | Julie | 6.42 | 0.0 | -104.39 | 2.15 | -14.09 | 2.16 | -6.12 | 0.94 | 0.0063 | 390.0 | True |
| 18433 | 18 | RL_8 | G11 | 1 | 49 | Julie | 6.42 | 0.0 | -104.80 | 2.12 | -14.66 | 2.13 | -6.37 | 0.93 | 0.0099 | 320.0 | True |
| Project | RUN | System | Guest | Microstate | CLONE | Person | dG2 (kT) | dG2 sigma (kT) | L WL-increment | ns of L simulation | Included |
|---|---|---|---|---|---|---|---|---|---|---|---|
| 18434 | 19 | L | G11 | 1 | 0 | Julie | 83.46 | 0.61 | 0.0302 | 30.0 | False |
| 18434 | 19 | L | G11 | 1 | 1 | Julie | 83.72 | 0.31 | 0.0003 | 110.0 | True |
| 18434 | 19 | L | G11 | 1 | 2 | Julie | 83.73 | 0.25 | 0.0000 | 270.0 | True |
| 18434 | 19 | L | G11 | 1 | 3 | Julie | 83.72 | 0.27 | 0.0000 | 250.35 | True |
| 18434 | 19 | L | G11 | 1 | 4 | Julie | 83.84 | 0.26 | 0.0002 | 180.05 | True |
| 18434 | 19 | L | G11 | 1 | 5 | Julie | 83.83 | 0.28 | 0.0002 | 160.0 | True |
| 18434 | 19 | L | G11 | 1 | 6 | Julie | 83.72 | 0.31 | 0.0001 | 220.3 | True |
| 18434 | 19 | L | G11 | 1 | 7 | Julie | 83.79 | 0.22 | 0.0000 | 240.0 | True |
| 18434 | 19 | L | G11 | 1 | 8 | Julie | 83.79 | 0.21 | 0.0000 | 277.0 | True |
| 18434 | 19 | L | G11 | 1 | 9 | Julie | 83.73 | 0.21 | 0.0000 | 232.6 | True |
| 18434 | 19 | L | G11 | 1 | 10 | Julie | 83.91 | 0.22 | 0.0001 | 240.0 | True |
| 18434 | 19 | L | G11 | 1 | 11 | Julie | 83.78 | 0.28 | 0.0007 | 140.0 | True |
| 18434 | 19 | L | G11 | 1 | 12 | Julie | 83.75 | 0.25 | 0.0000 | 239.25 | True |
| 18434 | 19 | L | G11 | 1 | 13 | Julie | 83.78 | 0.26 | 0.0000 | 220.0 | True |
| 18434 | 19 | L | G11 | 1 | 14 | Julie | 83.69 | 0.16 | 0.0000 | 250.15 | True |
| 18434 | 19 | L | G11 | 1 | 15 | Julie | 83.87 | 0.24 | 0.0000 | 294.45 | True |
| 18434 | 19 | L | G11 | 1 | 16 | Julie | 83.78 | 0.20 | 0.0000 | 220.0 | True |
| 18434 | 19 | L | G11 | 1 | 17 | Julie | 83.73 | 0.29 | 0.0001 | 220.1 | True |
| 18434 | 19 | L | G11 | 1 | 18 | Julie | 83.75 | 0.20 | 0.0000 | 254.65 | True |
| 18434 | 19 | L | G11 | 1 | 19 | Julie | 83.71 | 0.21 | 0.0000 | 282.8 | True |
| 18434 | 19 | L | G11 | 1 | 20 | Julie | 83.79 | 0.21 | 0.0002 | 160.4 | True |
| 18434 | 19 | L | G11 | 1 | 21 | Julie | 83.80 | 0.23 | 0.0001 | 180.0 | True |
| 18434 | 19 | L | G11 | 1 | 22 | Julie | 83.86 | 0.30 | 0.0007 | 140.0 | True |
| 18434 | 19 | L | G11 | 1 | 23 | Julie | 83.67 | 0.18 | 0.0000 | 251.5 | True |
| 18434 | 19 | L | G11 | 1 | 24 | Julie | 83.88 | 0.20 | 0.0000 | 270.05 | True |
| 18434 | 19 | L | G11 | 1 | 25 | Julie | 83.74 | 0.29 | 0.0009 | 130.0 | True |
| 18434 | 19 | L | G11 | 1 | 26 | Julie | 83.74 | 0.21 | 0.0003 | 170.0 | True |
| 18434 | 19 | L | G11 | 1 | 27 | Julie | 83.90 | 0.36 | 0.0003 | 150.15 | True |
| 18434 | 19 | L | G11 | 1 | 28 | Julie | 83.86 | 0.19 | 0.0000 | 278.45 | True |
| 18434 | 19 | L | G11 | 1 | 29 | Julie | 83.76 | 0.39 | 0.0007 | 130.0 | True |
| 18434 | 19 | L | G11 | 1 | 30 | Julie | 83.88 | 0.21 | 0.0000 | 229.1 | True |
| 18434 | 19 | L | G11 | 1 | 31 | Julie | 83.73 | 0.27 | 0.0000 | 240.05 | True |
| 18434 | 19 | L | G11 | 1 | 32 | Julie | 83.80 | 0.25 | 0.0000 | 200.05 | True |
| 18434 | 19 | L | G11 | 1 | 33 | Julie | 83.83 | 0.15 | 0.0000 | 279.95 | True |
| 18434 | 19 | L | G11 | 1 | 34 | Julie | 83.83 | 0.21 | 0.0000 | 240.0 | True |
| 18434 | 19 | L | G11 | 1 | 35 | Julie | 83.81 | 0.23 | 0.0002 | 140.0 | True |
| 18434 | 19 | L | G11 | 1 | 36 | Julie | 83.87 | 0.22 | 0.0000 | 250.1 | True |
| 18434 | 19 | L | G11 | 1 | 37 | Julie | 83.91 | 0.38 | 0.0013 | 90.0 | True |
| 18434 | 19 | L | G11 | 1 | 38 | Julie | 83.72 | 0.35 | 0.0007 | 130.15 | True |
| 18434 | 19 | L | G11 | 1 | 39 | Julie | 83.83 | 0.26 | 0.0001 | 200.1 | True |
| 18434 | 19 | L | G11 | 1 | 40 | Julie | 83.79 | 0.28 | 0.0000 | 230.0 | True |
| 18434 | 19 | L | G11 | 1 | 41 | Julie | 83.72 | 0.22 | 0.0003 | 120.0 | True |
| 18434 | 19 | L | G11 | 1 | 42 | Julie | 83.89 | 0.30 | 0.0002 | 200.0 | True |
| 18434 | 19 | L | G11 | 1 | 43 | Julie | 83.64 | 0.19 | 0.0000 | 263.55 | True |
| 18434 | 19 | L | G11 | 1 | 44 | Julie | 83.76 | 0.15 | 0.0000 | 242.7 | True |
| 18434 | 19 | L | G11 | 1 | 45 | Julie | 83.75 | 0.27 | 0.0002 | 190.2 | True |
| 18434 | 19 | L | G11 | 1 | 46 | Julie | 83.80 | 0.21 | 0.0000 | 210.95 | True |
| 18434 | 19 | L | G11 | 1 | 47 | Julie | 83.83 | 0.29 | 0.0002 | 170.0 | True |
| 18434 | 19 | L | G11 | 1 | 48 | Julie | 83.89 | 0.27 | 0.0002 | 190.0 | True |
| 18434 | 19 | L | G11 | 1 | 49 | Julie | 83.73 | 0.21 | 0.0000 | 240.1 | True |