| RUN | Initial microstate | Final microstate | ΔΔG / kcal M-1 | Work distribution | Convergence | ||||||
|---|---|---|---|---|---|---|---|---|---|---|---|
| RUN4552 | MAT-POS-b3e365b9-1_1 |
|
EN300-246992_3_1_1 |
|
−1.8 ± 0.3 |
|
|
||||
| RUN7048 | MAT-POS-b3e365b9-1_1 |
|
EN300-1073320_3_2_1 |
|
−1.8 ± 0.3 |
|
|
||||
| RUN3819 | MAT-POS-b3e365b9-1_1 |
|
EN300-153257_3_2_1 |
|
−1.8 ± 0.3 |
|
|
||||
| RUN3204 | MAT-POS-b3e365b9-1_1 |
|
EN300-7456641_1_1_1 |
|
−1.8 ± 0.3 |
|
|
||||
| RUN4536 | MAT-POS-b3e365b9-1_1 |
|
EN300-6499531_1_1_1 |
|
−1.8 ± 0.3 |
|
|
||||
| RUN5426 | MAT-POS-b3e365b9-1_1 |
|
EN300-34636_1_1_1 |
|
−1.8 ± 0.3 |
|
|
||||
| RUN3113 | MAT-POS-b3e365b9-1_1 |
|
EN300-139167_3_1_1 |
|
−1.8 ± 0.3 |
|
|
||||
| RUN1561 | MAT-POS-b3e365b9-1_1 |
|
EDG-MED-90036822-33_2 |
|
−1.8 ± 0.2 |
|
|
||||
| RUN6136 | MAT-POS-b3e365b9-1_1 |
|
EN300-173006_1_2_1 |
|
−1.8 ± 0.2 |
|
|
||||
| RUN3156 | MAT-POS-b3e365b9-1_1 |
|
EN300-6729747_1_1_3 |
|
−1.8 ± 0.4 |
|
|
||||
| RUN793 | MAT-POS-b3e365b9-1_1 |
|
DAR-DIA-0d514e7d-4_1 |
|
−1.8 ± 0.2 |
|
|
||||
| RUN4793 | MAT-POS-b3e365b9-1_1 |
|
EN300-79536_1_1_1 |
|
−1.8 ± 0.3 |
|
|
||||
| RUN4382 | MAT-POS-b3e365b9-1_1 |
|
EN300-302058_1_1_1 |
|
−1.8 ± 0.3 |
|
|
||||
| RUN3904 | MAT-POS-b3e365b9-1_1 |
|
EN300-52325_1_1_1 |
|
−1.8 ± 0.3 |
|
|
||||
| RUN3345 | MAT-POS-b3e365b9-1_1 |
|
EN300-316196_1_1_1 |
|
−1.8 ± 0.3 |
|
|
||||
| RUN1995 | MAT-POS-b3e365b9-1_1 |
|
MAT-POS-090737b9-1_1 |
|
−1.8 ± 0.2 |
|
|
||||
| RUN4873 | MAT-POS-b3e365b9-1_1 |
|
EN300-176877_1_1_1 |
|
−1.8 ± 0.3 |
|
|
||||
| RUN3914 | MAT-POS-b3e365b9-1_1 |
|
EN300-10334_1_1_1 |
|
−1.8 ± 0.3 |
|
|
||||
| RUN4557 | MAT-POS-b3e365b9-1_1 |
|
EN300-98099_1_1_1 |
|
−1.8 ± 0.2 |
|
|
||||
| RUN6746 | MAT-POS-b3e365b9-1_1 |
|
EN300-6277108_3_1_1 |
|
−1.8 ± 0.3 |
|
|
||||
| RUN7122 | MAT-POS-b3e365b9-1_1 |
|
EN300-248526_1_1_1 |
|
−1.8 ± 0.3 |
|
|
||||
| RUN5634 | MAT-POS-b3e365b9-1_1 |
|
EN300-260418_1_1_1 |
|
−1.8 ± 0.3 |
|
|
||||
| RUN4260 | MAT-POS-b3e365b9-1_1 |
|
EN300-146174_3_1_1 |
|
−1.8 ± 0.3 |
|
|
||||
| RUN3559 | MAT-POS-b3e365b9-1_1 |
|
EN300-191904_1_1_1 |
|
−1.8 ± 0.3 |
|
|
||||
| RUN6615 | MAT-POS-b3e365b9-1_1 |
|
EN300-300217_3_3_1 |
|
−1.8 ± 0.3 |
|
|
||||
| RUN4543 | MAT-POS-b3e365b9-1_1 |
|
EN300-317555_3_1_1 |
|
−1.8 ± 0.2 |
|
|
||||
| RUN6865 | MAT-POS-b3e365b9-1_1 |
|
EN300-1073264_3_1_1 |
|
−1.8 ± 0.3 |
|
|
||||
| RUN3669 | MAT-POS-b3e365b9-1_1 |
|
EN300-6277108_1_3_1 |
|
−1.8 ± 0.3 |
|
|
||||
| RUN3452 | MAT-POS-b3e365b9-1_1 |
|
EN300-142957_1_1_1 |
|
−1.8 ± 0.2 |
|
|
||||
| RUN3266 | MAT-POS-b3e365b9-1_1 |
|
EN300-36522_1_1_1 |
|
−1.8 ± 0.3 |
|
|
||||
| RUN3804 | MAT-POS-b3e365b9-1_1 |
|
EN300-317555_1_1_1 |
|
−1.8 ± 0.2 |
|
|
||||
| RUN3151 | MAT-POS-b3e365b9-1_1 |
|
EN300-184266_1_1_1 |
|
−1.8 ± 0.2 |
|
|
||||
| RUN4450 | MAT-POS-b3e365b9-1_1 |
|
EN300-14437_1_2_1 |
|
−1.8 ± 0.2 |
|
|
||||
| RUN2981 | MAT-POS-b3e365b9-1_1 |
|
EN300-1589101_1_1_1 |
|
−1.8 ± 0.2 |
|
|
||||
| RUN3245 | MAT-POS-b3e365b9-1_1 |
|
EN300-149224_1_1_1 |
|
−1.8 ± 0.2 |
|
|
||||
| RUN5676 | MAT-POS-b3e365b9-1_1 |
|
EN300-173562_1_2_1 |
|
−1.8 ± 0.3 |
|
|
||||
| RUN4033 | MAT-POS-b3e365b9-1_1 |
|
EN300-370967_3_1_1 |
|
−1.8 ± 0.3 |
|
|
||||
| RUN4011 | MAT-POS-b3e365b9-1_1 |
|
EN300-36158_3_2_1 |
|
−1.8 ± 0.2 |
|
|
||||
| RUN4805 | MAT-POS-b3e365b9-1_1 |
|
EN300-10895_1_1_1 |
|
−1.8 ± 0.2 |
|
|
||||
| RUN3677 | MAT-POS-b3e365b9-1_1 |
|
EN300-316216_3_1_1 |
|
−1.8 ± 0.3 |
|
|
||||
| RUN2751 | MAT-POS-b3e365b9-1_1 |
|
EN300-103435_2_1_1 |
|
−1.8 ± 0.3 |
|
|
||||
| RUN1565 | MAT-POS-b3e365b9-1_1 |
|
EDG-MED-90036822-20_1 |
|
−1.8 ± 0.2 |
|
|
||||
| RUN3223 | MAT-POS-b3e365b9-1_1 |
|
EN300-6729572_1_4_1 |
|
−1.8 ± 0.2 |
|
|
||||
| RUN4814 | MAT-POS-b3e365b9-1_1 |
|
EN300-6255179_1_1_1 |
|
−1.8 ± 0.2 |
|
|
||||
| RUN3743 | MAT-POS-b3e365b9-1_1 |
|
EN300-211203_3_2_1 |
|
−1.8 ± 0.4 |
|
|
||||
| RUN4258 | MAT-POS-b3e365b9-1_1 |
|
EN300-113234_3_1_1 |
|
−1.8 ± 0.4 |
|
|
||||
| RUN3778 | MAT-POS-b3e365b9-1_1 |
|
EN300-6487134_1_1_1 |
|
−1.8 ± 0.3 |
|
|
||||
| RUN4172 | MAT-POS-b3e365b9-1_1 |
|
EN300-19700_3_1_1 |
|
−1.8 ± 0.3 |
|
|
||||
| RUN5226 | MAT-POS-b3e365b9-1_1 |
|
EN300-754584_3_1_1 |
|
−1.8 ± 0.2 |
|
|
||||
| RUN4473 | MAT-POS-b3e365b9-1_1 |
|
EN300-195590_1_2_1 |
|
−1.8 ± 0.4 |
|
|
||||
| RUN3902 | MAT-POS-b3e365b9-1_1 |
|
EN300-175186_4_1_1 |
|
−1.8 ± 0.3 |
|
|
||||
| RUN3262 | MAT-POS-b3e365b9-1_1 |
|
EN300-125769_1_1_1 |
|
−1.8 ± 0.3 |
|
|
||||
| RUN4812 | MAT-POS-b3e365b9-1_1 |
|
EN300-02067_1_1_1 |
|
−1.8 ± 0.3 |
|
|
||||
| RUN2938 | MAT-POS-b3e365b9-1_1 |
|
EN300-269453_1_2_1 |
|
−1.8 ± 0.2 |
|
|
||||
| RUN2407 | MAT-POS-b3e365b9-1_1 |
|
EDJ-MED-40433386-3_1 |
|
−1.8 ± 0.4 |
|
|
||||
| RUN3791 | MAT-POS-b3e365b9-1_1 |
|
EN300-1600517_3_2_1 |
|
−1.8 ± 0.3 |
|
|
||||
| RUN5254 | MAT-POS-b3e365b9-1_1 |
|
EN300-7355519_3_5_1 |
|
−1.8 ± 0.3 |
|
|
||||
| RUN3907 | MAT-POS-b3e365b9-1_1 |
|
EN300-90142_1_1_1 |
|
−1.8 ± 0.3 |
|
|
||||
| RUN4402 | MAT-POS-b3e365b9-1_1 |
|
EN300-139167_1_1_1 |
|
−1.8 ± 0.3 |
|
|
||||
| RUN3089 | MAT-POS-b3e365b9-1_1 |
|
EN300-173006_2_1_1 |
|
−1.8 ± 0.3 |
|
|
||||
| RUN4520 | MAT-POS-b3e365b9-1_1 |
|
EN300-62074_1_2_1 |
|
−1.8 ± 0.3 |
|
|
||||
| RUN4081 | MAT-POS-b3e365b9-1_1 |
|
EN300-717276_1_1_1 |
|
−1.8 ± 0.2 |
|
|
||||
| RUN6344 | MAT-POS-b3e365b9-1_1 |
|
EN300-78368_3_1_1 |
|
−1.8 ± 0.4 |
|
|
||||
| RUN3461 | MAT-POS-b3e365b9-1_1 |
|
EN300-20233_1_1_1 |
|
−1.8 ± 0.2 |
|
|
||||
| RUN1662 | MAT-POS-b3e365b9-1_1 |
|
EDG-MED-90036822-71_1 |
|
−1.8 ± 0.3 |
|
|
||||
| RUN3060 | MAT-POS-b3e365b9-1_1 |
|
EN300-23318_3_4_1 |
|
−1.8 ± 0.3 |
|
|
||||
| RUN703 | MAT-POS-b3e365b9-1_1 |
|
MAK-UNK-3875bbc8-1_1 |
|
−1.77 ± 0.09 |
|
|
||||
| RUN4929 | MAT-POS-b3e365b9-1_1 |
|
EN300-74448_1_1_1 |
|
−1.8 ± 0.3 |
|
|
||||
| RUN3737 | MAT-POS-b3e365b9-1_1 |
|
EN300-7355519_1_2_1 |
|
−1.8 ± 0.3 |
|
|
||||
| RUN342 | MAT-POS-b3e365b9-1_1 |
|
VLA-UCB-50c39ae8-8_1 |
|
−1.8 ± 0.2 |
|
|
||||
| RUN5277 | MAT-POS-b3e365b9-1_1 |
|
EN300-71405_3_1_1 |
|
−1.8 ± 0.3 |
|
|
||||
| RUN4665 | MAT-POS-b3e365b9-1_1 |
|
EN300-46832_1_1_1 |
|
−1.8 ± 0.2 |
|
|
||||
| RUN311 | MAT-POS-b3e365b9-1_1 |
|
VLA-UCB-05e51b3f-12_1 |
|
−1.8 ± 0.5 |
|
|
||||
| RUN4786 | MAT-POS-b3e365b9-1_1 |
|
EN300-120282_1_1_1 |
|
−1.8 ± 0.2 |
|
|
||||
| RUN5310 | MAT-POS-b3e365b9-1_1 |
|
EN300-4726186_1_1_1 |
|
−1.8 ± 0.4 |
|
|
||||
| RUN3988 | MAT-POS-b3e365b9-1_1 |
|
DAR-DIA-6a508060-5_3_1 |
|
−1.8 ± 0.2 |
|
|
||||
| RUN2769 | MAT-POS-b3e365b9-1_1 |
|
EN300-250126_1_1_1 |
|
−1.8 ± 0.3 |
|
|
||||
| RUN4270 | MAT-POS-b3e365b9-1_1 |
|
EN300-1717596_1_1_1 |
|
−1.8 ± 0.3 |
|
|
||||
| RUN2914 | MAT-POS-b3e365b9-1_1 |
|
EN300-94945_2_1_1 |
|
−1.8 ± 0.2 |
|
|
||||
| RUN1693 | MAT-POS-b3e365b9-1_1 |
|
EDG-MED-90036822-104_1 |
|
−1.8 ± 0.3 |
|
|
||||
| RUN2958 | MAT-POS-b3e365b9-1_1 |
|
EN300-1968342_3_1_1 |
|
−1.8 ± 0.3 |
|
|
||||
| RUN4349 | MAT-POS-b3e365b9-1_1 |
|
EN300-139167_1_1_1 |
|
−1.8 ± 0.3 |
|
|
||||
| RUN4347 | MAT-POS-b3e365b9-1_1 |
|
EN300-358956_1_1_1 |
|
−1.8 ± 0.4 |
|
|
||||
| RUN3292 | MAT-POS-b3e365b9-1_1 |
|
EN300-6479181_1_2_1 |
|
−1.8 ± 0.3 |
|
|
||||
| RUN3211 | MAT-POS-b3e365b9-1_1 |
|
EN300-52009_1_1_1 |
|
−1.8 ± 0.3 |
|
|
||||
| RUN1542 | MAT-POS-b3e365b9-1_1 |
|
EDG-MED-90036822-17_1 |
|
−1.8 ± 0.3 |
|
|
||||
| RUN4008 | MAT-POS-b3e365b9-1_1 |
|
EN300-1072972_1_2_1 |
|
−1.8 ± 0.2 |
|
|
||||
| RUN3242 | MAT-POS-b3e365b9-1_1 |
|
EN300-219330_1_1_1 |
|
−1.8 ± 0.2 |
|
|
||||
| RUN566 | MAT-POS-b3e365b9-1_1 |
|
MIC-UNK-50cce87d-11_1 |
|
−1.8 ± 0.3 |
|
|
||||
| RUN6424 | MAT-POS-b3e365b9-1_1 |
|
EN300-321789_2_1_1 |
|
−1.8 ± 0.2 |
|
|
||||
| RUN4320 | MAT-POS-b3e365b9-1_1 |
|
EN300-6356960_1_1_1 |
|
−1.8 ± 0.3 |
|
|
||||
| RUN4255 | MAT-POS-b3e365b9-1_1 |
|
EN300-96362_3_2_1 |
|
−1.8 ± 0.4 |
|
|
||||
| RUN3309 | MAT-POS-b3e365b9-1_1 |
|
EN300-92031_3_1_1 |
|
−1.8 ± 0.7 |
|
|
||||
| RUN4351 | MAT-POS-b3e365b9-1_1 |
|
EN300-219020_1_1_1 |
|
−1.8 ± 0.2 |
|
|
||||
| RUN4550 | MAT-POS-b3e365b9-1_1 |
|
EN300-6745453_1_2_1 |
|
−1.8 ± 0.3 |
|
|
||||
| RUN5516 | MAT-POS-b3e365b9-1_1 |
|
EN300-103144_3_1_1 |
|
−1.7 ± 0.4 |
|
|
||||
| RUN2360 | MAT-POS-b3e365b9-1_1 |
|
EDJ-MED-fcba3f31-8_1 |
|
−1.7 ± 0.2 |
|
|
||||
| RUN3584 | MAT-POS-b3e365b9-1_1 |
|
EN300-189563_3_1_1 |
|
−1.7 ± 0.3 |
|
|
||||
| RUN3067 | MAT-POS-b3e365b9-1_1 |
|
VLA-UCB-34f3ed0c-8_1_1 |
|
−1.7 ± 0.2 |
|
|
||||
| RUN2967 | MAT-POS-b3e365b9-1_1 |
|
EN300-7430501_1_2_1 |
|
−1.7 ± 0.3 |
|
|
||||