Transformations

Showing 101 through 200 of 100
RUN Atom map Initial microstate Final microstate ΔΔG / kcal M-1 Work distribution Bootstrapping Convergence
RUN566 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-50a80394-1_2 molecule −0.2 ± 0.4 work distributions bootstrapping convergence
RUN576 VLA-UCB-50c39ae8-2_1 molecule PET-UNK-94036022-4_1 molecule −0.2 ± 0.3 work distributions bootstrapping convergence
RUN418 VLA-UCB-50c39ae8-2_1 molecule MIK-ENA-37e0b697-1_1 molecule −0.2 ± 0.1 work distributions bootstrapping convergence
RUN550 VLA-UCB-50c39ae8-2_1 molecule PET-UNK-94036022-2_1 molecule −0.2 ± 0.3 work distributions bootstrapping convergence
RUN520 VLA-UCB-50c39ae8-2_1 molecule ALP-POS-ecbed2ba-16_1 molecule −0.2 ± 0.6 work distributions bootstrapping convergence
RUN636 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-853c0ffa-12_1 molecule −0.2 ± 0.4 work distributions bootstrapping convergence
RUN408 VLA-UCB-50c39ae8-2_1 molecule LUO-POS-9931618f-1_1 molecule −0.2 ± 0.1 work distributions bootstrapping convergence
RUN394 VLA-UCB-50c39ae8-2_1 molecule PET-UNK-14142a25-10_1 molecule −0.2 ± 0.1 work distributions bootstrapping convergence
RUN480 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-cc48ee33-7_1 molecule −0.1 ± 0.2 work distributions bootstrapping convergence
RUN369 VLA-UCB-50c39ae8-2_1 molecule BEN-BAS-c2bc0d80-7_1 molecule −0.11 ± 0.08 work distributions bootstrapping convergence
RUN377 VLA-UCB-50c39ae8-2_1 molecule PET-UNK-aa57768f-3_1 molecule −0.10 ± 0.09 work distributions bootstrapping convergence
RUN464 VLA-UCB-50c39ae8-2_1 molecule PET-UNK-77d5678a-3_1 molecule −0.10 ± 0.08 work distributions bootstrapping convergence
RUN536 VLA-UCB-50c39ae8-2_1 molecule ALP-POS-ecbed2ba-6_1 molecule −0.1 ± 0.2 work distributions bootstrapping convergence
RUN564 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-7d88f880-1_2 molecule −0.1 ± 0.1 work distributions bootstrapping convergence
RUN482 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-576f7758-2_1 molecule −0.1 ± 0.1 work distributions bootstrapping convergence
RUN630 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-853c0ffa-20_1 molecule −0.1 ± 0.3 work distributions bootstrapping convergence
RUN351 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-983b399a-1_1 molecule −0.07 ± 0.05 work distributions bootstrapping convergence
RUN522 VLA-UCB-50c39ae8-2_1 molecule ALP-POS-ecbed2ba-10_1 molecule −0.1 ± 0.3 work distributions bootstrapping convergence
RUN555 VLA-UCB-50c39ae8-2_1 molecule LUO-POS-868e8996-9_1 molecule −0.1 ± 0.3 work distributions bootstrapping convergence
RUN506 VLA-UCB-50c39ae8-2_1 molecule PET-UNK-94036022-10_1 molecule −0.0 ± 0.2 work distributions bootstrapping convergence
RUN353 VLA-UCB-50c39ae8-2_1 molecule VLA-UCB-50c39ae8-2_1 molecule −0.02 ± 0.04 work distributions bootstrapping convergence
RUN495 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-e48723dc-2_1 molecule −0.0 ± 0.1 work distributions bootstrapping convergence
RUN573 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-a12e3a20-1_1 molecule −0.0 ± 0.3 work distributions bootstrapping convergence
RUN356 VLA-UCB-50c39ae8-2_1 molecule BEN-BAS-c2bc0d80-6_1 molecule −0.01 ± 0.04 work distributions bootstrapping convergence
RUN586 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-853c0ffa-14_1 molecule −0.0 ± 0.2 work distributions bootstrapping convergence
RUN663 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-40ad851a-1_1 molecule 0.0 ± 0.7 work distributions bootstrapping convergence
RUN671 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-40ad851a-3_1 molecule 0.0 ± 0.8 work distributions bootstrapping convergence
RUN531 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-b6c6ee2b-7_1 molecule 0.0 ± 0.1 work distributions bootstrapping convergence
RUN368 VLA-UCB-50c39ae8-2_1 molecule VLA-UNK-56836b69-2_1 molecule 0.0 ± 0.1 work distributions bootstrapping convergence
RUN363 VLA-UCB-50c39ae8-2_1 molecule VLA-UCB-05e51b3f-5_1 molecule 0.02 ± 0.04 work distributions bootstrapping convergence
RUN361 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-94643566-1_1 molecule 0.02 ± 0.03 work distributions bootstrapping convergence
RUN445 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-b6c6ee2b-6_1 molecule 0.0 ± 0.1 work distributions bootstrapping convergence
RUN366 VLA-UCB-50c39ae8-2_1 molecule VLA-UNK-3a43cd95-1_1 molecule 0.04 ± 0.07 work distributions bootstrapping convergence
RUN626 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-38eb6498-2_1 molecule 0.0 ± 0.2 work distributions bootstrapping convergence
RUN670 VLA-UCB-50c39ae8-2_1 molecule JOH-MSK-949975c8-1_2 molecule 0.1 ± 0.3 work distributions bootstrapping convergence
RUN591 VLA-UCB-50c39ae8-2_1 molecule ALP-POS-ecbed2ba-22_1 molecule 0.1 ± 0.3 work distributions bootstrapping convergence
RUN534 VLA-UCB-50c39ae8-2_1 molecule MIK-ENA-5d9157e9-2_1 molecule 0.1 ± 0.4 work distributions bootstrapping convergence
RUN560 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-fed7ac0b-3_1 molecule 0.1 ± 0.3 work distributions bootstrapping convergence
RUN450 VLA-UCB-50c39ae8-2_1 molecule PET-UNK-aa57768f-7_1 molecule 0.1 ± 0.1 work distributions bootstrapping convergence
RUN412 VLA-UCB-50c39ae8-2_1 molecule LUO-POS-9931618f-2_1 molecule 0.1 ± 0.1 work distributions bootstrapping convergence
RUN425 VLA-UCB-50c39ae8-2_1 molecule EDG-MED-b1ef7fe3-1_1 molecule 0.1 ± 0.2 work distributions bootstrapping convergence
RUN352 VLA-UCB-50c39ae8-2_1 molecule DAR-DIA-6be260fc-5_1 molecule 0.08 ± 0.07 work distributions bootstrapping convergence
RUN657 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-9f4ac58c-3_1 molecule 0.1 ± 0.6 work distributions bootstrapping convergence
RUN488 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-50a80394-5_2 molecule 0.1 ± 0.2 work distributions bootstrapping convergence
RUN579 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-b6c6ee2b-4_1 molecule 0.1 ± 0.4 work distributions bootstrapping convergence
RUN392 VLA-UCB-50c39ae8-2_1 molecule PET-UNK-14142a25-1_1 molecule 0.1 ± 0.1 work distributions bootstrapping convergence
RUN421 VLA-UCB-50c39ae8-2_1 molecule MIK-ENA-794411b8-1_1 molecule 0.1 ± 0.1 work distributions bootstrapping convergence
RUN355 VLA-UCB-50c39ae8-2_1 molecule ALP-POS-477dc5b7-4_1 molecule 0.12 ± 0.06 work distributions bootstrapping convergence
RUN431 VLA-UCB-50c39ae8-2_1 molecule EDG-MED-b1ef7fe3-4_1 molecule 0.1 ± 0.1 work distributions bootstrapping convergence
RUN656 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-ee81482e-2_1 molecule 0.1 ± 0.5 work distributions bootstrapping convergence
RUN658 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-40ad851a-2_1 molecule 0.2 ± 0.7 work distributions bootstrapping convergence
RUN390 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-8bb691af-8_1 molecule 0.2 ± 0.1 work distributions bootstrapping convergence
RUN474 VLA-UCB-50c39ae8-2_1 molecule ALP-POS-ecbed2ba-19_1 molecule 0.2 ± 0.3 work distributions bootstrapping convergence
RUN590 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-5cd3920d-4_1 molecule 0.2 ± 0.1 work distributions bootstrapping convergence
RUN401 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-fed7ac0b-4_1 molecule 0.2 ± 0.1 work distributions bootstrapping convergence
RUN529 VLA-UCB-50c39ae8-2_1 molecule ALP-POS-ecbed2ba-4_1 molecule 0.2 ± 0.3 work distributions bootstrapping convergence
RUN484 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-fed7ac0b-2_1 molecule 0.2 ± 0.1 work distributions bootstrapping convergence
RUN446 VLA-UCB-50c39ae8-2_1 molecule ALP-POS-ecbed2ba-18_1 molecule 0.2 ± 0.2 work distributions bootstrapping convergence
RUN428 VLA-UCB-50c39ae8-2_1 molecule EDG-MED-b1ef7fe3-2_1 molecule 0.2 ± 0.1 work distributions bootstrapping convergence
RUN584 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-98c0a822-2_1 molecule 0.2 ± 0.2 work distributions bootstrapping convergence
RUN519 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-853c0ffa-21_1 molecule 0.2 ± 0.2 work distributions bootstrapping convergence
RUN376 VLA-UCB-50c39ae8-2_1 molecule DAR-DIA-0f7b7cd9-8_1 molecule 0.25 ± 0.07 work distributions bootstrapping convergence
RUN605 VLA-UCB-50c39ae8-2_1 molecule VLA-UNK-61877630-8_1 molecule 0.3 ± 0.3 work distributions bootstrapping convergence
RUN577 VLA-UCB-50c39ae8-2_1 molecule VLA-UNK-61877630-7_1 molecule 0.3 ± 0.3 work distributions bootstrapping convergence
RUN515 VLA-UCB-50c39ae8-2_1 molecule ALP-POS-ecbed2ba-13_1 molecule 0.3 ± 0.3 work distributions bootstrapping convergence
RUN606 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-976a33d5-2_1 molecule 0.3 ± 0.2 work distributions bootstrapping convergence
RUN462 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-a12e3a20-2_1 molecule 0.3 ± 0.1 work distributions bootstrapping convergence
RUN342 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-159244ea-1_1 molecule 0.32 ± 0.08 work distributions bootstrapping convergence
RUN372 VLA-UCB-50c39ae8-2_1 molecule PET-UNK-aa57768f-9_1 molecule 0.3 ± 0.1 work distributions bootstrapping convergence
RUN551 VLA-UCB-50c39ae8-2_1 molecule PET-UNK-94036022-9_1 molecule 0.3 ± 0.3 work distributions bootstrapping convergence
RUN387 VLA-UCB-50c39ae8-2_1 molecule VLA-UNK-56836b69-5_1 molecule 0.4 ± 0.1 work distributions bootstrapping convergence
RUN535 VLA-UCB-50c39ae8-2_1 molecule MIK-ENA-5d9157e9-1_1 molecule 0.4 ± 0.4 work distributions bootstrapping convergence
RUN427 VLA-UCB-50c39ae8-2_1 molecule VLA-UNK-f702bf1c-3_1 molecule 0.4 ± 0.2 work distributions bootstrapping convergence
RUN563 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-7d88f880-1_1 molecule 0.4 ± 0.2 work distributions bootstrapping convergence
RUN358 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-ec6d90b7-1_1 molecule 0.43 ± 0.04 work distributions bootstrapping convergence
RUN350 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-90505e2b-1_1 molecule 0.44 ± 0.05 work distributions bootstrapping convergence
RUN404 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-fed7ac0b-1_1 molecule 0.5 ± 0.1 work distributions bootstrapping convergence
RUN559 VLA-UCB-50c39ae8-2_1 molecule PET-UNK-94036022-11_1 molecule 0.5 ± 0.3 work distributions bootstrapping convergence
RUN370 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-ec6d90b7-2_1 molecule 0.49 ± 0.04 work distributions bootstrapping convergence
RUN473 VLA-UCB-50c39ae8-2_1 molecule ALP-POS-ecbed2ba-3_1 molecule 0.5 ± 0.2 work distributions bootstrapping convergence
RUN528 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-98c0a822-4_1 molecule 0.5 ± 0.1 work distributions bootstrapping convergence
RUN612 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-7d88f880-2_1 molecule 0.5 ± 0.2 work distributions bootstrapping convergence
RUN666 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-468565e0-1_1 molecule 0.5 ± 0.5 work distributions bootstrapping convergence
RUN432 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-853c0ffa-1_1 molecule 0.5 ± 0.1 work distributions bootstrapping convergence
RUN654 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-40ad851a-4_1 molecule 0.5 ± 0.5 work distributions bootstrapping convergence
RUN596 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-50a80394-2_1 molecule 0.5 ± 0.4 work distributions bootstrapping convergence
RUN367 VLA-UCB-50c39ae8-2_1 molecule DAR-DIA-0f7b7cd9-9_1 molecule 0.54 ± 0.07 work distributions bootstrapping convergence
RUN561 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-853c0ffa-13_1 molecule 0.5 ± 0.3 work distributions bootstrapping convergence
RUN442 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-96396902-1_1 molecule 0.5 ± 0.1 work distributions bootstrapping convergence
RUN588 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-98c0a822-1_1 molecule 0.6 ± 0.6 work distributions bootstrapping convergence
RUN624 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-50a80394-3_1 molecule 0.6 ± 0.3 work distributions bootstrapping convergence
RUN459 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-1d5ab790-3_1 molecule 0.6 ± 0.1 work distributions bootstrapping convergence
RUN512 VLA-UCB-50c39ae8-2_1 molecule PET-UNK-94036022-3_1 molecule 0.6 ± 0.2 work distributions bootstrapping convergence
RUN470 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-fd8ed875-5_1 molecule 0.6 ± 0.1 work distributions bootstrapping convergence
RUN433 VLA-UCB-50c39ae8-2_1 molecule EDG-MED-b1ef7fe3-3_1 molecule 0.6 ± 0.1 work distributions bootstrapping convergence
RUN532 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-fd8ed875-6_1 molecule 0.6 ± 0.1 work distributions bootstrapping convergence
RUN537 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-1bed62cf-1_1 molecule 0.7 ± 0.3 work distributions bootstrapping convergence
RUN385 VLA-UCB-50c39ae8-2_1 molecule EDJ-MED-7587a9ee-3_1 molecule 0.7 ± 0.2 work distributions bootstrapping convergence
RUN493 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-e48723dc-1_1 molecule 0.7 ± 0.1 work distributions bootstrapping convergence
RUN346 VLA-UCB-50c39ae8-2_1 molecule MAT-POS-983b399a-3_1 molecule 0.68 ± 0.07 work distributions bootstrapping convergence
Last updated 2022-01-14T22:36:05.598648+00:00
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