Transformations

Showing 1 through 100 of 100
RUN Atom map Initial microstate Final microstate ΔΔG / kcal M-1 Work distribution Bootstrapping Convergence
RUN797 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-c2d406ed-1_2 molecule −3.0 ± 0.3 work distributions bootstrapping convergence
RUN807 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-c2d406ed-1_1 molecule −3.0 ± 0.2 work distributions bootstrapping convergence
RUN851 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-c2d406ed-2_2 molecule −2.3 ± 0.3 work distributions bootstrapping convergence
RUN714 VLA-UCB-50c39ae8-2_1 molecule VLA-UNK-f702bf1c-5_1 molecule −2.3 ± 0.2 work distributions bootstrapping convergence
RUN580 VLA-UCB-50c39ae8-2_1 molecule VLA-MRT-8c78ee15-3_2 molecule −2.1 ± 0.2 work distributions bootstrapping convergence
RUN855 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-c2d406ed-4_2 molecule −2.0 ± 0.3 work distributions bootstrapping convergence
RUN852 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-c2d406ed-4_1 molecule −2.0 ± 0.3 work distributions bootstrapping convergence
RUN715 VLA-UCB-50c39ae8-2_1 molecule VLA-UNK-f702bf1c-5_2 molecule −2.0 ± 0.1 work distributions bootstrapping convergence
RUN520 VLA-UCB-50c39ae8-2_1 molecule VLA-UNK-56836b69-2_1 molecule −1.97 ± 0.08 work distributions bootstrapping convergence
RUN812 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-c2d406ed-3_2 molecule −1.9 ± 0.3 work distributions bootstrapping convergence
RUN668 VLA-UCB-50c39ae8-2_1 molecule VLA-UNK-f702bf1c-6_1 molecule −1.9 ± 0.2 work distributions bootstrapping convergence
RUN677 VLA-UCB-50c39ae8-2_1 molecule VLA-UNK-f702bf1c-1_1 molecule −1.9 ± 0.1 work distributions bootstrapping convergence
RUN530 VLA-UCB-50c39ae8-2_1 molecule VLA-UNK-56836b69-5_1 molecule −1.9 ± 0.1 work distributions bootstrapping convergence
RUN661 VLA-UCB-50c39ae8-2_1 molecule VLA-UCB-34f3ed0c-14_1 molecule −1.8 ± 0.1 work distributions bootstrapping convergence
RUN718 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-8bb691af-5_1 molecule −1.7 ± 0.4 work distributions bootstrapping convergence
RUN529 VLA-UCB-50c39ae8-2_1 molecule VLA-UNK-3a43cd95-1_1 molecule −1.69 ± 0.07 work distributions bootstrapping convergence
RUN849 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-c2d406ed-2_1 molecule −1.7 ± 0.2 work distributions bootstrapping convergence
RUN554 VLA-UCB-50c39ae8-2_1 molecule VLA-MRT-a639d434-2_2 molecule −1.5 ± 0.2 work distributions bootstrapping convergence
RUN782 VLA-UCB-50c39ae8-2_1 molecule LUO-POS-868e8996-9_1 molecule −1.5 ± 0.3 work distributions bootstrapping convergence
RUN551 VLA-UCB-50c39ae8-2_1 molecule VLA-MRT-8c78ee15-4_2 molecule −1.5 ± 0.2 work distributions bootstrapping convergence
RUN582 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-2e8b2191-8_2 molecule −1.5 ± 0.1 work distributions bootstrapping convergence
RUN811 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-c2d406ed-3_1 molecule −1.4 ± 0.2 work distributions bootstrapping convergence
RUN514 VLA-UCB-50c39ae8-2_1 molecule VLA-UCB-34f3ed0c-11_1 molecule −1.42 ± 0.05 work distributions bootstrapping convergence
RUN783 VLA-UCB-50c39ae8-2_1 molecule LUO-POS-868e8996-10_1 molecule −1.3 ± 0.3 work distributions bootstrapping convergence
RUN509 VLA-UCB-50c39ae8-2_1 molecule VLA-UNK-cf7facf1-1_1 molecule −1.26 ± 0.05 work distributions bootstrapping convergence
RUN572 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-7587a9ee-1_1 molecule −1.3 ± 0.1 work distributions bootstrapping convergence
RUN573 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-7587a9ee-1_2 molecule −1.2 ± 0.1 work distributions bootstrapping convergence
RUN516 VLA-UCB-50c39ae8-2_1 molecule VLA-UCB-29506327-1_1 molecule −1.20 ± 0.06 work distributions bootstrapping convergence
RUN574 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-2e8b2191-8_1 molecule −1.2 ± 0.1 work distributions bootstrapping convergence
RUN575 VLA-UCB-50c39ae8-2_1 molecule VLA-MRT-a639d434-1_1 molecule −1.0 ± 0.2 work distributions bootstrapping convergence
RUN674 VLA-UCB-50c39ae8-2_1 molecule VLA-UNK-f702bf1c-4_2 molecule −1.0 ± 0.1 work distributions bootstrapping convergence
RUN622 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-1bed62cf-2_1 molecule −0.9 ± 0.1 work distributions bootstrapping convergence
RUN679 VLA-UCB-50c39ae8-2_1 molecule VLA-UNK-f702bf1c-8_1 molecule −0.9 ± 0.2 work distributions bootstrapping convergence
RUN827 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-be048f2c-8_1 molecule −0.9 ± 0.2 work distributions bootstrapping convergence
RUN767 VLA-UCB-50c39ae8-2_1 molecule PET-UNK-94036022-5_1 molecule −0.9 ± 0.2 work distributions bootstrapping convergence
RUN623 VLA-UCB-50c39ae8-2_1 molecule VLA-UNK-f702bf1c-2_1 molecule −0.9 ± 0.1 work distributions bootstrapping convergence
RUN780 VLA-UCB-50c39ae8-2_1 molecule LUO-POS-868e8996-9_2 molecule −0.9 ± 0.3 work distributions bootstrapping convergence
RUN843 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-9f4ac58c-5_1 molecule −0.8 ± 0.3 work distributions bootstrapping convergence
RUN524 VLA-UCB-50c39ae8-2_1 molecule VLA-UNK-56836b69-3_1 molecule −0.81 ± 0.10 work distributions bootstrapping convergence
RUN838 VLA-UCB-50c39ae8-2_1 molecule PET-UNK-94036022-11_1 molecule −0.8 ± 0.2 work distributions bootstrapping convergence
RUN614 VLA-UCB-50c39ae8-2_1 molecule JOH-MSK-1f2dff76-1_1 molecule −0.8 ± 0.3 work distributions bootstrapping convergence
RUN903 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-9f4ac58c-4_1 molecule −0.8 ± 0.4 work distributions bootstrapping convergence
RUN909 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-9f4ac58c-8_1 molecule −0.8 ± 0.4 work distributions bootstrapping convergence
RUN778 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-1bed62cf-1_1 molecule −0.8 ± 0.3 work distributions bootstrapping convergence
RUN676 VLA-UCB-50c39ae8-2_1 molecule VLA-UNK-f702bf1c-4_1 molecule −0.8 ± 0.2 work distributions bootstrapping convergence
RUN630 VLA-UCB-50c39ae8-2_1 molecule LUO-POS-868e8996-7_1 molecule −0.7 ± 0.1 work distributions bootstrapping convergence
RUN856 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-50a80394-2_2 molecule −0.7 ± 0.5 work distributions bootstrapping convergence
RUN955 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-40ad851a-3_1 molecule −0.7 ± 0.5 work distributions bootstrapping convergence
RUN555 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-8bb691af-3_2 molecule −0.7 ± 0.2 work distributions bootstrapping convergence
RUN624 VLA-UCB-50c39ae8-2_1 molecule VLA-UNK-f702bf1c-3_1 molecule −0.7 ± 0.1 work distributions bootstrapping convergence
RUN577 VLA-UCB-50c39ae8-2_1 molecule VLA-MRT-8c78ee15-3_1 molecule −0.7 ± 0.2 work distributions bootstrapping convergence
RUN632 VLA-UCB-50c39ae8-2_1 molecule LUO-POS-868e8996-8_1 molecule −0.7 ± 0.1 work distributions bootstrapping convergence
RUN769 VLA-UCB-50c39ae8-2_1 molecule PET-UNK-94036022-5_2 molecule −0.6 ± 0.3 work distributions bootstrapping convergence
RUN892 VLA-UCB-50c39ae8-2_1 molecule LUO-POS-b5068a05-2_1 molecule −0.6 ± 0.3 work distributions bootstrapping convergence
RUN775 VLA-UCB-50c39ae8-2_1 molecule PET-UNK-94036022-12_1 molecule −0.5 ± 0.2 work distributions bootstrapping convergence
RUN774 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-1bed62cf-1_2 molecule −0.5 ± 0.5 work distributions bootstrapping convergence
RUN521 VLA-UCB-50c39ae8-2_1 molecule BEN-BAS-c2bc0d80-7_1 molecule −0.51 ± 0.07 work distributions bootstrapping convergence
RUN581 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-1bed62cf-3_2 molecule −0.5 ± 0.2 work distributions bootstrapping convergence
RUN579 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-8bb691af-9_1 molecule −0.4 ± 0.1 work distributions bootstrapping convergence
RUN777 VLA-UCB-50c39ae8-2_1 molecule PET-UNK-94036022-12_2 molecule −0.4 ± 0.4 work distributions bootstrapping convergence
RUN836 VLA-UCB-50c39ae8-2_1 molecule PET-UNK-94036022-4_2 molecule −0.3 ± 0.3 work distributions bootstrapping convergence
RUN584 VLA-UCB-50c39ae8-2_1 molecule VLA-MRT-a639d434-1_2 molecule −0.3 ± 0.2 work distributions bootstrapping convergence
RUN823 VLA-UCB-50c39ae8-2_1 molecule PET-UNK-94036022-4_1 molecule −0.3 ± 0.3 work distributions bootstrapping convergence
RUN828 VLA-UCB-50c39ae8-2_1 molecule PET-UNK-94036022-11_2 molecule −0.2 ± 0.3 work distributions bootstrapping convergence
RUN550 VLA-UCB-50c39ae8-2_1 molecule VLA-MRT-8c78ee15-4_1 molecule −0.2 ± 0.2 work distributions bootstrapping convergence
RUN552 VLA-UCB-50c39ae8-2_1 molecule VLA-MRT-a639d434-2_1 molecule −0.1 ± 0.2 work distributions bootstrapping convergence
RUN952 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-40ad851a-1_4 molecule −0.1 ± 0.5 work distributions bootstrapping convergence
RUN518 VLA-UCB-50c39ae8-2_1 molecule VLA-MRT-8c78ee15-1_1 molecule −0.1 ± 0.2 work distributions bootstrapping convergence
RUN861 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-50a80394-2_4 molecule −0.1 ± 0.5 work distributions bootstrapping convergence
RUN972 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-dfa1d800-3_1 molecule −0.1 ± 0.3 work distributions bootstrapping convergence
RUN939 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-ee81482e-3_1 molecule −0.1 ± 0.7 work distributions bootstrapping convergence
RUN507 VLA-UCB-50c39ae8-2_1 molecule BEN-BAS-c2bc0d80-6_1 molecule −0.06 ± 0.03 work distributions bootstrapping convergence
RUN958 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-40ad851a-1_6 molecule −0.1 ± 0.6 work distributions bootstrapping convergence
RUN505 VLA-UCB-50c39ae8-2_1 molecule VLA-UCB-50c39ae8-2_1 molecule −0.02 ± 0.03 work distributions bootstrapping convergence
RUN504 VLA-UCB-50c39ae8-2_1 molecule VLA-UCB-05e51b3f-5_1 molecule −0.01 ± 0.02 work distributions bootstrapping convergence
RUN526 VLA-UCB-50c39ae8-2_1 molecule VLA-MRT-a639d434-3_1 molecule 0.0 ± 0.2 work distributions bootstrapping convergence
RUN508 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-94643566-1_1 molecule 0.03 ± 0.02 work distributions bootstrapping convergence
RUN619 VLA-UCB-50c39ae8-2_1 molecule JOH-MSK-1f2dff76-1_2 molecule 0.1 ± 0.2 work distributions bootstrapping convergence
RUN946 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-dfa1d800-5_1 molecule 0.1 ± 0.2 work distributions bootstrapping convergence
RUN525 VLA-UCB-50c39ae8-2_1 molecule VLA-UNK-3a43cd95-3_1 molecule 0.15 ± 0.05 work distributions bootstrapping convergence
RUN512 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-983b399a-3_1 molecule 0.15 ± 0.08 work distributions bootstrapping convergence
RUN523 VLA-UCB-50c39ae8-2_1 molecule VLA-MRT-8c78ee15-2_1 molecule 0.2 ± 0.2 work distributions bootstrapping convergence
RUN510 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-90505e2b-1_1 molecule 0.19 ± 0.04 work distributions bootstrapping convergence
RUN513 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-ec6d90b7-2_1 molecule 0.19 ± 0.04 work distributions bootstrapping convergence
RUN784 VLA-UCB-50c39ae8-2_1 molecule LUO-POS-868e8996-10_2 molecule 0.2 ± 0.4 work distributions bootstrapping convergence
RUN621 VLA-UCB-50c39ae8-2_1 molecule JOH-MSK-1f2dff76-2_2 molecule 0.2 ± 0.2 work distributions bootstrapping convergence
RUN717 VLA-UCB-50c39ae8-2_1 molecule VLA-UNK-f702bf1c-7_1 molecule 0.2 ± 0.3 work distributions bootstrapping convergence
RUN759 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-98c0a822-3_1 molecule 0.2 ± 0.2 work distributions bootstrapping convergence
RUN585 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-1bed62cf-3_1 molecule 0.2 ± 0.3 work distributions bootstrapping convergence
RUN880 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-50a80394-3_2 molecule 0.3 ± 0.4 work distributions bootstrapping convergence
RUN771 VLA-UCB-50c39ae8-2_1 molecule PET-UNK-94036022-2_1 molecule 0.3 ± 0.4 work distributions bootstrapping convergence
RUN853 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-50a80394-2_3 molecule 0.4 ± 0.4 work distributions bootstrapping convergence
RUN511 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-ec6d90b7-1_1 molecule 0.40 ± 0.04 work distributions bootstrapping convergence
RUN968 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-468565e0-2_2 molecule 0.4 ± 0.7 work distributions bootstrapping convergence
RUN859 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-b6c6ee2b-3_1 molecule 0.5 ± 0.3 work distributions bootstrapping convergence
RUN728 VLA-UCB-50c39ae8-2_1 molecule ALP-POS-ecbed2ba-4_1 molecule 0.5 ± 0.4 work distributions bootstrapping convergence
RUN494 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-159244ea-3_1 molecule 0.5 ± 0.1 work distributions bootstrapping convergence
RUN912 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-b6c6ee2b-5_1 molecule 0.5 ± 0.3 work distributions bootstrapping convergence
RUN553 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-8bb691af-3_1 molecule 0.5 ± 0.2 work distributions bootstrapping convergence
RUN908 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-5cd3920d-3_1 molecule 0.5 ± 0.2 work distributions bootstrapping convergence
Last updated 2022-01-08T06:37:21.173141+00:00
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