| RUN | Initial microstate | Final microstate | ΔΔG / kcal M-1 | Work distribution | Convergence | ||||||
|---|---|---|---|---|---|---|---|---|---|---|---|
| RUN288 | MAT-POS-b3e365b9-1_1 |
|
MAT-POS-8a69d52e-4_2 |
|
−1.01 ± 0.05 |
|
|
||||
| RUN4167 | MAT-POS-b3e365b9-1_1 |
|
EN300-1664603_3_1_1 |
|
−1.0 ± 0.2 |
|
|
||||
| RUN3254 | MAT-POS-b3e365b9-1_1 |
|
EN300-256762_1_1_1 |
|
−1.0 ± 0.3 |
|
|
||||
| RUN4860 | MAT-POS-b3e365b9-1_1 |
|
EN300-158082_1_1_1 |
|
−1.0 ± 0.4 |
|
|
||||
| RUN6008 | MAT-POS-b3e365b9-1_1 |
|
EN300-76841_3_2_1 |
|
−1.0 ± 0.4 |
|
|
||||
| RUN4430 | MAT-POS-b3e365b9-1_1 |
|
DAR-DIA-0d514e7d-6_1_1 |
|
−1.0 ± 0.2 |
|
|
||||
| RUN2385 | MAT-POS-b3e365b9-1_1 |
|
EDJ-MED-d203f206-20_1 |
|
−1.0 ± 0.3 |
|
|
||||
| RUN3749 | MAT-POS-b3e365b9-1_1 |
|
EN300-207959_1_2_1 |
|
−1.0 ± 0.3 |
|
|
||||
| RUN5326 | MAT-POS-b3e365b9-1_1 |
|
EN300-216673_1_1_1 |
|
−1.0 ± 0.2 |
|
|
||||
| RUN4899 | MAT-POS-b3e365b9-1_1 |
|
EN300-177118_1_2_1 |
|
−1.0 ± 0.2 |
|
|
||||
| RUN2387 | MAT-POS-b3e365b9-1_1 |
|
EDJ-MED-fcba3f31-12_1 |
|
−1.0 ± 0.2 |
|
|
||||
| RUN4080 | MAT-POS-b3e365b9-1_1 |
|
EN300-1708848_1_1_1 |
|
−1.0 ± 0.4 |
|
|
||||
| RUN5975 | MAT-POS-b3e365b9-1_1 |
|
EN300-6779469_1_1_1 |
|
−1.0 ± 0.2 |
|
|
||||
| RUN5538 | MAT-POS-b3e365b9-1_1 |
|
EN300-817811_1_1_1 |
|
−1.0 ± 0.2 |
|
|
||||
| RUN5439 | MAT-POS-b3e365b9-1_1 |
|
EN300-207765_1_1_1 |
|
−1.0 ± 0.3 |
|
|
||||
| RUN4092 | MAT-POS-b3e365b9-1_1 |
|
EN300-7183657_1_1_1 |
|
−1.0 ± 0.2 |
|
|
||||
| RUN1796 | MAT-POS-b3e365b9-1_1 |
|
RAL-THA-2d450e86-17_1 |
|
−1.0 ± 0.3 |
|
|
||||
| RUN3473 | MAT-POS-b3e365b9-1_1 |
|
EN300-761746_3_1_1 |
|
−1.0 ± 0.3 |
|
|
||||
| RUN1975 | MAT-POS-b3e365b9-1_1 |
|
KAD-UNI-8a629cb0-24_1 |
|
−1.0 ± 0.3 |
|
|
||||
| RUN2030 | MAT-POS-b3e365b9-1_1 |
|
KAD-UNI-8a629cb0-29_1 |
|
−1.0 ± 0.3 |
|
|
||||
| RUN1935 | MAT-POS-b3e365b9-1_1 |
|
DAR-DIA-6be260fc-2_1 |
|
−1.0 ± 0.3 |
|
|
||||
| RUN4783 | MAT-POS-b3e365b9-1_1 |
|
EN300-862647_3_1_1 |
|
−1.0 ± 0.3 |
|
|
||||
| RUN4196 | MAT-POS-b3e365b9-1_1 |
|
EN300-92605_1_1_1 |
|
−1.0 ± 0.4 |
|
|
||||
| RUN4556 | MAT-POS-b3e365b9-1_1 |
|
EN300-132624_3_1_1 |
|
−1.0 ± 0.3 |
|
|
||||
| RUN4470 | MAT-POS-b3e365b9-1_1 |
|
EN300-91609_1_4_1 |
|
−1.0 ± 0.3 |
|
|
||||
| RUN7580 | MAT-POS-b3e365b9-1_1 |
|
EN300-132963_1_1_1 |
|
−1.0 ± 0.3 |
|
|
||||
| RUN412 | MAT-POS-b3e365b9-1_1 |
|
DAR-DIA-23e5a6a0-2_2 |
|
−1.0 ± 0.3 |
|
|
||||
| RUN4896 | MAT-POS-b3e365b9-1_1 |
|
EN300-11195_2_1_1 |
|
−1.0 ± 0.2 |
|
|
||||
| RUN3931 | MAT-POS-b3e365b9-1_1 |
|
EN300-761618_3_1_1 |
|
−1.0 ± 0.3 |
|
|
||||
| RUN6328 | MAT-POS-b3e365b9-1_1 |
|
EN300-6478631_3_2_1 |
|
−1.0 ± 0.3 |
|
|
||||
| RUN5190 | MAT-POS-b3e365b9-1_1 |
|
EN300-98429_1_1_1 |
|
−1.0 ± 0.3 |
|
|
||||
| RUN4538 | MAT-POS-b3e365b9-1_1 |
|
EN300-11441_3_1_1 |
|
−1.0 ± 0.3 |
|
|
||||
| RUN5464 | MAT-POS-b3e365b9-1_1 |
|
EN300-154912_1_1_1 |
|
−1.0 ± 0.3 |
|
|
||||
| RUN6414 | MAT-POS-b3e365b9-1_1 |
|
EN300-7355737_3_1_1 |
|
−1.0 ± 0.4 |
|
|
||||
| RUN1314 | MAT-POS-b3e365b9-1_1 |
|
LAU-MED-88a3970a-1_1 |
|
−1.0 ± 0.2 |
|
|
||||
| RUN4565 | MAT-POS-b3e365b9-1_1 |
|
EN300-64536_1_1_1 |
|
−1.0 ± 0.2 |
|
|
||||
| RUN1636 | MAT-POS-b3e365b9-1_1 |
|
EDG-MED-90036822-80_2 |
|
−1.0 ± 0.2 |
|
|
||||
| RUN4861 | MAT-POS-b3e365b9-1_1 |
|
EN300-321790_1_1_1 |
|
−1.0 ± 0.2 |
|
|
||||
| RUN4596 | MAT-POS-b3e365b9-1_1 |
|
EN300-196140_1_2_1 |
|
−1.0 ± 0.4 |
|
|
||||
| RUN7564 | MAT-POS-b3e365b9-1_1 |
|
EN300-301690_1_2_1 |
|
−1.0 ± 0.3 |
|
|
||||
| RUN417 | MAT-POS-b3e365b9-1_1 |
|
DAR-DIA-23e5a6a0-1_1 |
|
−1.0 ± 0.3 |
|
|
||||
| RUN5478 | MAT-POS-b3e365b9-1_1 |
|
EN300-310888_1_1_1 |
|
−1.0 ± 0.3 |
|
|
||||
| RUN2353 | MAT-POS-b3e365b9-1_1 |
|
EDJ-MED-fcba3f31-1_1 |
|
−1.0 ± 0.2 |
|
|
||||
| RUN3933 | MAT-POS-b3e365b9-1_1 |
|
EN300-179091_3_1_1 |
|
−1.0 ± 0.2 |
|
|
||||
| RUN3817 | MAT-POS-b3e365b9-1_1 |
|
EN300-139167_1_2_1 |
|
−1.0 ± 0.2 |
|
|
||||
| RUN6855 | MAT-POS-b3e365b9-1_1 |
|
EN300-205486_1_1_1 |
|
−1.0 ± 0.3 |
|
|
||||
| RUN4340 | MAT-POS-b3e365b9-1_1 |
|
EN300-214800_4_1_1 |
|
−1.0 ± 0.3 |
|
|
||||
| RUN7494 | MAT-POS-b3e365b9-1_1 |
|
EN300-120562_1_3_1 |
|
−1.0 ± 0.3 |
|
|
||||
| RUN4206 | MAT-POS-b3e365b9-1_1 |
|
EN300-7535922_1_1_1 |
|
−1.0 ± 0.3 |
|
|
||||
| RUN4589 | MAT-POS-b3e365b9-1_1 |
|
EN300-246248_2_1_1 |
|
−1.0 ± 0.2 |
|
|
||||
| RUN6605 | MAT-POS-b3e365b9-1_1 |
|
EN300-151461_2_2_1 |
|
−1.0 ± 0.4 |
|
|
||||