| 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 | 10 | RL_8 | G5 | 1 | 0 | Jason | 6.42 | 0.0 | 186.44 | 3.97 | -12.09 | 4.01 | -5.25 | 1.74 | 0.0193 | 370.0 | True |
| 18433 | 10 | RL_8 | G5 | 1 | 1 | Jason | 6.42 | 0.0 | 187.67 | 3.64 | -11.01 | 3.71 | -4.78 | 1.61 | 0.0155 | 350.0 | True |
| 18433 | 10 | RL_8 | G5 | 1 | 2 | Jason | 6.42 | 0.0 | 186.77 | 3.77 | -11.73 | 3.79 | -5.09 | 1.65 | 0.0302 | 180.0 | False |
| 18433 | 10 | RL_8 | G5 | 1 | 3 | Jason | 6.42 | 0.0 | 191.22 | 5.89 | -7.28 | 5.90 | -3.16 | 2.56 | 0.0242 | 220.0 | False |
| 18433 | 10 | RL_8 | G5 | 1 | 4 | Jason | 6.42 | 0.0 | 186.81 | 3.91 | -11.69 | 3.93 | -5.08 | 1.71 | 0.0124 | 320.0 | True |
| 18433 | 10 | RL_8 | G5 | 1 | 5 | Jason | 6.42 | 0.0 | 188.26 | 4.60 | -10.35 | 4.63 | -4.50 | 2.01 | 0.0242 | 360.35 | False |
| 18433 | 10 | RL_8 | G5 | 1 | 6 | Jason | 6.42 | 0.0 | 188.02 | 4.77 | -10.57 | 4.78 | -4.59 | 2.07 | 0.0155 | 450.0 | True |
| 18433 | 10 | RL_8 | G5 | 1 | 7 | Jason | 6.42 | 0.0 | 187.82 | 5.33 | -10.71 | 5.35 | -4.65 | 2.32 | 0.0302 | 280.4 | False |
| 18433 | 10 | RL_8 | G5 | 1 | 8 | Jason | 6.42 | 0.0 | 187.27 | 4.19 | -11.35 | 4.20 | -4.93 | 1.82 | 0.0155 | 300.0 | True |
| 18433 | 10 | RL_8 | G5 | 1 | 9 | Jason | 6.42 | 0.0 | 189.80 | 4.02 | -8.93 | 4.05 | -3.88 | 1.76 | 0.0302 | 180.0 | False |
| 18433 | 10 | RL_8 | G5 | 1 | 10 | Jason | 6.42 | 0.0 | 188.68 | 4.46 | -9.94 | 4.49 | -4.32 | 1.95 | 0.0155 | 350.1 | True |
| 18433 | 10 | RL_8 | G5 | 1 | 11 | Jason | 6.42 | 0.0 | 187.30 | 3.56 | -11.11 | 3.59 | -4.83 | 1.56 | 0.0155 | 380.0 | True |
| 18433 | 10 | RL_8 | G5 | 1 | 12 | Jason | 6.42 | 0.0 | 189.34 | 3.82 | -9.26 | 3.85 | -4.02 | 1.67 | 0.0302 | 190.0 | False |
| 18433 | 10 | RL_8 | G5 | 1 | 13 | Jason | 6.42 | 0.0 | 188.49 | 5.01 | -10.02 | 5.03 | -4.35 | 2.18 | 0.0242 | 260.0 | False |
| 18433 | 10 | RL_8 | G5 | 1 | 14 | Jason | 6.42 | 0.0 | 187.77 | 4.69 | -10.88 | 4.72 | -4.72 | 2.05 | 0.0302 | 210.0 | False |
| 18433 | 10 | RL_8 | G5 | 1 | 15 | Jason | 6.42 | 0.0 | 188.06 | 4.72 | -10.57 | 4.73 | -4.59 | 2.05 | 0.0193 | 380.0 | True |
| 18433 | 10 | RL_8 | G5 | 1 | 16 | Jason | 6.42 | 0.0 | 186.48 | 4.24 | -12.04 | 4.26 | -5.23 | 1.85 | 0.0193 | 180.0 | True |
| 18433 | 10 | RL_8 | G5 | 1 | 17 | Jason | 6.42 | 0.0 | 187.90 | 4.35 | -10.61 | 4.36 | -4.61 | 1.89 | 0.0193 | 380.0 | True |
| 18433 | 10 | RL_8 | G5 | 1 | 18 | Jason | 6.42 | 0.0 | 188.51 | 3.43 | -10.08 | 3.47 | -4.38 | 1.51 | 0.0155 | 480.0 | True |
| 18433 | 10 | RL_8 | G5 | 1 | 19 | Jason | 6.42 | 0.0 | 187.95 | 4.35 | -10.65 | 4.38 | -4.63 | 1.90 | 0.0155 | 370.0 | True |
| 18433 | 10 | RL_8 | G5 | 1 | 20 | Jason | 6.42 | 0.0 | 188.51 | 3.77 | -9.92 | 3.81 | -4.31 | 1.65 | 0.0155 | 360.0 | True |
| 18433 | 10 | RL_8 | G5 | 1 | 21 | Jason | 6.42 | 0.0 | 188.48 | 3.43 | -10.24 | 3.46 | -4.45 | 1.50 | 0.0124 | 300.15 | True |
| 18433 | 10 | RL_8 | G5 | 1 | 22 | Jason | 6.42 | 0.0 | 188.32 | 3.71 | -10.10 | 3.74 | -4.39 | 1.63 | 0.0193 | 340.0 | True |
| 18433 | 10 | RL_8 | G5 | 1 | 23 | Jason | 6.42 | 0.0 | 187.76 | 3.96 | -10.76 | 4.00 | -4.67 | 1.74 | 0.0155 | 360.0 | True |
| 18433 | 10 | RL_8 | G5 | 1 | 24 | Jason | 6.42 | 0.0 | 188.62 | 4.00 | -9.98 | 4.01 | -4.33 | 1.74 | 0.0155 | 490.0 | True |
| 18433 | 10 | RL_8 | G5 | 1 | 25 | Jason | 6.42 | 0.0 | 188.19 | 3.57 | -10.32 | 3.61 | -4.48 | 1.57 | 0.0193 | 290.0 | True |
| 18433 | 10 | RL_8 | G5 | 1 | 26 | Jason | 6.42 | 0.0 | 188.25 | 3.94 | -10.33 | 3.97 | -4.49 | 1.72 | 0.0124 | 410.0 | True |
| 18433 | 10 | RL_8 | G5 | 1 | 27 | Jason | 6.42 | 0.0 | 188.37 | 3.82 | -10.09 | 3.84 | -4.38 | 1.67 | 0.0242 | 180.0 | False |
| 18433 | 10 | RL_8 | G5 | 1 | 28 | Jason | 6.42 | 0.0 | 187.61 | 4.01 | -10.86 | 4.04 | -4.72 | 1.76 | 0.0193 | 240.0 | True |
| 18433 | 10 | RL_8 | G5 | 1 | 29 | Jason | 6.42 | 0.0 | 189.12 | 4.74 | -9.42 | 4.76 | -4.09 | 2.07 | 0.0193 | 220.25 | True |
| 18433 | 10 | RL_8 | G5 | 1 | 30 | Jason | 6.42 | 0.0 | 188.83 | 3.48 | -9.70 | 3.50 | -4.21 | 1.52 | 0.0124 | 400.0 | True |
| 18433 | 10 | RL_8 | G5 | 1 | 31 | Jason | 6.42 | 0.0 | 187.74 | 4.06 | -10.77 | 4.08 | -4.68 | 1.77 | 0.0242 | 280.0 | False |
| 18433 | 10 | RL_8 | G5 | 1 | 32 | Jason | 6.42 | 0.0 | 188.54 | 4.76 | -10.10 | 4.80 | -4.39 | 2.08 | 0.0193 | 200.0 | True |
| 18433 | 10 | RL_8 | G5 | 1 | 33 | Jason | 6.42 | 0.0 | 188.18 | 4.10 | -10.32 | 4.13 | -4.48 | 1.79 | 0.0193 | 230.0 | True |
| 18433 | 10 | RL_8 | G5 | 1 | 34 | Jason | 6.42 | 0.0 | 187.83 | 5.19 | -10.96 | 5.22 | -4.76 | 2.27 | 0.0242 | 230.15 | False |
| 18433 | 10 | RL_8 | G5 | 1 | 35 | Jason | 6.42 | 0.0 | 190.18 | 5.89 | -8.35 | 5.90 | -3.63 | 2.56 | 0.0242 | 290.0 | False |
| 18433 | 10 | RL_8 | G5 | 1 | 36 | Jason | 6.42 | 0.0 | 188.50 | 4.58 | -15.03 | 4.58 | -6.53 | 1.99 | 0.0193 | 320.0 | True |
| 18433 | 10 | RL_8 | G5 | 1 | 37 | Jason | 6.42 | 0.0 | 189.24 | 4.48 | -9.36 | 4.49 | -4.07 | 1.95 | 0.0302 | 230.0 | False |
| 18433 | 10 | RL_8 | G5 | 1 | 38 | Jason | 6.42 | 0.0 | 188.52 | 4.82 | -10.12 | 4.85 | -4.39 | 2.11 | 0.0242 | 310.0 | False |
| 18433 | 10 | RL_8 | G5 | 1 | 39 | Jason | 6.42 | 0.0 | 187.96 | 4.38 | -10.66 | 4.41 | -4.63 | 1.91 | 0.0155 | 400.0 | True |
| 18433 | 10 | RL_8 | G5 | 1 | 40 | Jason | 6.42 | 0.0 | 188.14 | 3.71 | -10.33 | 3.73 | -4.49 | 1.62 | 0.0155 | 230.0 | True |
| 18433 | 10 | RL_8 | G5 | 1 | 41 | Jason | 6.42 | 0.0 | 186.45 | 4.23 | -12.12 | 4.26 | -5.26 | 1.85 | 0.0193 | 380.2 | True |
| 18433 | 10 | RL_8 | G5 | 1 | 42 | Jason | 6.42 | 0.0 | 188.36 | 4.78 | -10.12 | 4.80 | -4.39 | 2.09 | 0.0242 | 350.0 | False |
| 18433 | 10 | RL_8 | G5 | 1 | 43 | Jason | 6.42 | 0.0 | 188.91 | 4.52 | -9.69 | 4.54 | -4.21 | 1.97 | 0.0242 | 230.0 | False |
| 18433 | 10 | RL_8 | G5 | 1 | 44 | Jason | 6.42 | 0.0 | 188.58 | 5.75 | -10.12 | 5.76 | -4.40 | 2.50 | 0.0155 | 390.0 | True |
| 18433 | 10 | RL_8 | G5 | 1 | 45 | Jason | 6.42 | 0.0 | 187.74 | 4.45 | -10.83 | 4.47 | -4.71 | 1.94 | 0.0193 | 340.0 | True |
| 18433 | 10 | RL_8 | G5 | 1 | 46 | Jason | 6.42 | 0.0 | 189.21 | 5.28 | -9.31 | 5.29 | -4.04 | 2.30 | 0.0302 | 290.0 | False |
| 18433 | 10 | RL_8 | G5 | 1 | 47 | Jason | 6.42 | 0.0 | 188.47 | 4.54 | -10.01 | 4.57 | -4.35 | 1.98 | 0.0155 | 330.0 | True |
| 18433 | 10 | RL_8 | G5 | 1 | 48 | Jason | 6.42 | 0.0 | 187.23 | 4.34 | -11.43 | 4.36 | -4.96 | 1.89 | 0.0242 | 430.0 | False |
| 18433 | 10 | RL_8 | G5 | 1 | 49 | Jason | 6.42 | 0.0 | 188.26 | 4.09 | -10.28 | 4.12 | -4.46 | 1.79 | 0.0155 | 410.0 | True |
| Project | RUN | System | Guest | Microstate | CLONE | Person | dG2 (kT) | dG2 sigma (kT) | L WL-increment | ns of L simulation | Included |
|---|---|---|---|---|---|---|---|---|---|---|---|
| 18434 | 10 | L | G5 | 1 | 0 | Jason | -204.94 | 0.52 | 0.0026 | 110.0 | True |
| 18434 | 10 | L | G5 | 1 | 1 | Jason | -205.10 | 0.72 | 0.0099 | 70.25 | True |
| 18434 | 10 | L | G5 | 1 | 2 | Jason | -204.90 | 0.36 | 0.0009 | 200.05 | True |
| 18434 | 10 | L | G5 | 1 | 3 | Jason | -204.91 | 0.39 | 0.0007 | 210.0 | True |
| 18434 | 10 | L | G5 | 1 | 4 | Jason | -204.92 | 0.39 | 0.0011 | 150.0 | True |
| 18434 | 10 | L | G5 | 1 | 5 | Jason | -205.02 | 0.49 | 0.0021 | 120.0 | True |
| 18434 | 10 | L | G5 | 1 | 6 | Jason | -205.01 | 0.29 | 0.0003 | 200.0 | True |
| 18434 | 10 | L | G5 | 1 | 7 | Jason | -204.95 | 0.47 | 0.0005 | 210.0 | True |
| 18434 | 10 | L | G5 | 1 | 8 | Jason | -205.04 | 0.31 | 0.0011 | 160.05 | True |
| 18434 | 10 | L | G5 | 1 | 9 | Jason | -205.14 | 0.45 | 0.0011 | 170.2 | True |
| 18434 | 10 | L | G5 | 1 | 10 | Jason | -205.03 | 0.47 | 0.0017 | 170.0 | True |
| 18434 | 10 | L | G5 | 1 | 11 | Jason | -204.83 | 0.46 | 0.0021 | 180.0 | True |
| 18434 | 10 | L | G5 | 1 | 12 | Jason | -205.02 | 0.44 | 0.0011 | 160.0 | True |
| 18434 | 10 | L | G5 | 1 | 13 | Jason | -204.92 | 0.40 | 0.0011 | 170.15 | True |
| 18434 | 10 | L | G5 | 1 | 14 | Jason | -205.06 | 0.56 | 0.0009 | 170.0 | True |
| 18434 | 10 | L | G5 | 1 | 15 | Jason | -205.05 | 0.33 | 0.0001 | 280.0 | True |
| 18434 | 10 | L | G5 | 1 | 16 | Jason | -204.94 | 0.39 | 0.0007 | 180.0 | True |
| 18434 | 10 | L | G5 | 1 | 17 | Jason | -204.93 | 0.33 | 0.0001 | 290.0 | True |
| 18434 | 10 | L | G5 | 1 | 18 | Jason | -205.00 | 0.50 | 0.0032 | 110.0 | True |
| 18434 | 10 | L | G5 | 1 | 19 | Jason | -205.01 | 0.50 | 0.0009 | 210.0 | True |
| 18434 | 10 | L | G5 | 1 | 20 | Jason | -204.86 | 0.50 | 0.0009 | 170.0 | True |
| 18434 | 10 | L | G5 | 1 | 21 | Jason | -205.14 | 0.48 | 0.0004 | 210.0 | True |
| 18434 | 10 | L | G5 | 1 | 22 | Jason | -204.84 | 0.54 | 0.0013 | 160.0 | True |
| 18434 | 10 | L | G5 | 1 | 23 | Jason | -204.94 | 0.52 | 0.0009 | 190.0 | True |
| 18434 | 10 | L | G5 | 1 | 24 | Jason | -205.01 | 0.39 | 0.0003 | 190.0 | True |
| 18434 | 10 | L | G5 | 1 | 25 | Jason | -204.93 | 0.51 | 0.0011 | 180.0 | True |
| 18434 | 10 | L | G5 | 1 | 26 | Jason | -204.99 | 0.46 | 0.0013 | 170.05 | True |
| 18434 | 10 | L | G5 | 1 | 27 | Jason | -204.87 | 0.39 | 0.0005 | 220.0 | True |
| 18434 | 10 | L | G5 | 1 | 28 | Jason | -204.89 | 0.53 | 0.0013 | 180.0 | True |
| 18434 | 10 | L | G5 | 1 | 29 | Jason | -204.96 | 0.34 | 0.0002 | 290.15 | True |
| 18434 | 10 | L | G5 | 1 | 30 | Jason | -204.94 | 0.37 | 0.0003 | 190.0 | True |
| 18434 | 10 | L | G5 | 1 | 31 | Jason | -204.93 | 0.40 | 0.0007 | 220.0 | True |
| 18434 | 10 | L | G5 | 1 | 32 | Jason | -205.06 | 0.60 | 0.0026 | 130.0 | True |
| 18434 | 10 | L | G5 | 1 | 33 | Jason | -204.91 | 0.42 | 0.0009 | 180.0 | True |
| 18434 | 10 | L | G5 | 1 | 34 | Jason | -205.21 | 0.53 | 0.0017 | 150.0 | True |
| 18434 | 10 | L | G5 | 1 | 35 | Jason | -204.95 | 0.36 | 0.0017 | 150.0 | True |
| 18434 | 10 | L | G5 | 1 | 36 | Jason | -209.94 | 0.00 | 0.4398 | 10.0 | False |
| 18434 | 10 | L | G5 | 1 | 37 | Jason | -205.02 | 0.37 | 0.0005 | 180.0 | True |
| 18434 | 10 | L | G5 | 1 | 38 | Jason | -205.06 | 0.53 | 0.0021 | 140.0 | True |
| 18434 | 10 | L | G5 | 1 | 39 | Jason | -205.04 | 0.48 | 0.0011 | 170.0 | True |
| 18434 | 10 | L | G5 | 1 | 40 | Jason | -204.89 | 0.36 | 0.0007 | 220.0 | True |
| 18434 | 10 | L | G5 | 1 | 41 | Jason | -204.99 | 0.53 | 0.0017 | 180.0 | True |
| 18434 | 10 | L | G5 | 1 | 42 | Jason | -204.89 | 0.42 | 0.0007 | 190.0 | True |
| 18434 | 10 | L | G5 | 1 | 43 | Jason | -205.02 | 0.43 | 0.0005 | 200.0 | True |
| 18434 | 10 | L | G5 | 1 | 44 | Jason | -205.11 | 0.39 | 0.0004 | 210.0 | True |
| 18434 | 10 | L | G5 | 1 | 45 | Jason | -204.99 | 0.39 | 0.0001 | 250.0 | True |
| 18434 | 10 | L | G5 | 1 | 46 | Jason | -204.93 | 0.38 | 0.0005 | 180.0 | True |
| 18434 | 10 | L | G5 | 1 | 47 | Jason | -204.90 | 0.48 | 0.0017 | 150.0 | True |
| 18434 | 10 | L | G5 | 1 | 48 | Jason | -205.07 | 0.42 | 0.0013 | 140.0 | True |
| 18434 | 10 | L | G5 | 1 | 49 | Jason | -204.96 | 0.49 | 0.0032 | 130.4 | True |