Transformations

Showing 101 through 200 of 100
RUN Initial microstate Final microstate ΔΔG / kcal M-1 Work distribution Convergence
RUN768 ADA-UCB-6c2cb422-1_1 molecule PET-UNK-ac320b15-9_1 molecule −0.9 ± 0.2 work distributions convergence plot
RUN727 ADA-UCB-6c2cb422-1_1 molecule PET-UNK-1320d94d-1_1 molecule −0.8 ± 0.2 work distributions convergence plot
RUN729 ADA-UCB-6c2cb422-1_1 molecule PET-UNK-1320d94d-2_1 molecule −0.8 ± 0.2 work distributions convergence plot
RUN542 ADA-UCB-6c2cb422-1_1 molecule JOH-UNI-ee5ed7c8-7_2 molecule −0.8 ± 0.3 work distributions convergence plot
RUN736 ADA-UCB-6c2cb422-1_1 molecule PET-UNK-1320d94d-3_1 molecule −0.8 ± 0.2 work distributions convergence plot
RUN351 ADA-UCB-6c2cb422-1_1 molecule MIC-UNK-5a93dd5f-2_2 molecule −0.8 ± 0.2 work distributions convergence plot
RUN445 ADA-UCB-6c2cb422-1_1 molecule MIC-UNK-5a93dd5f-12_5 molecule −0.8 ± 0.2 work distributions convergence plot
RUN370 ADA-UCB-6c2cb422-1_1 molecule MIC-UNK-5a93dd5f-3_6 molecule −0.8 ± 0.2 work distributions convergence plot
RUN396 ADA-UCB-6c2cb422-1_1 molecule MIC-UNK-5a93dd5f-3_11 molecule −0.7 ± 0.2 work distributions convergence plot
RUN356 ADA-UCB-6c2cb422-1_1 molecule MIC-UNK-5a93dd5f-2_3 molecule −0.7 ± 0.2 work distributions convergence plot
RUN556 ADA-UCB-6c2cb422-1_1 molecule JOH-UNI-3fc3434e-7_2 molecule −0.7 ± 0.2 work distributions convergence plot
RUN598 ADA-UCB-6c2cb422-1_1 molecule EDJ-MED-ee07cf00-11_5 molecule −0.7 ± 0.2 work distributions convergence plot
RUN760 ADA-UCB-6c2cb422-1_1 molecule PET-UNK-ac320b15-8_1 molecule −0.7 ± 0.2 work distributions convergence plot
RUN622 ADA-UCB-6c2cb422-1_1 molecule EDJ-MED-cf4b0d25-4_2 molecule −0.7 ± 0.1 work distributions convergence plot
RUN69 ADA-UCB-6c2cb422-1_1 molecule TRY-UNI-9f475305-3_1 molecule −0.7 ± 0.1 work distributions convergence plot
RUN700 ADA-UCB-6c2cb422-1_1 molecule PET-UNK-6314f867-2_1 molecule −0.7 ± 0.1 work distributions convergence plot
RUN579 ADA-UCB-6c2cb422-1_1 molecule EDJ-MED-ee07cf00-6_1 molecule −0.7 ± 0.2 work distributions convergence plot
RUN740 ADA-UCB-6c2cb422-1_1 molecule PET-UNK-1320d94d-27_1 molecule −0.6 ± 0.2 work distributions convergence plot
RUN594 ADA-UCB-6c2cb422-1_1 molecule EDJ-MED-ee07cf00-13_2 molecule −0.6 ± 0.2 work distributions convergence plot
RUN50 ADA-UCB-6c2cb422-1_1 molecule JAN-GHE-5a013bed-1_1 molecule −0.6 ± 0.1 work distributions convergence plot
RUN583 ADA-UCB-6c2cb422-1_1 molecule EDJ-MED-ee07cf00-6_4 molecule −0.6 ± 0.2 work distributions convergence plot
RUN486 ADA-UCB-6c2cb422-1_1 molecule JOH-UNI-a38a7bdd-8_4 molecule −0.6 ± 0.2 work distributions convergence plot
RUN650 ADA-UCB-6c2cb422-1_1 molecule JIN-POS-6dc588a4-17_1 molecule −0.6 ± 0.2 work distributions convergence plot
RUN774 ADA-UCB-6c2cb422-1_1 molecule MAT-POS-8293a91a-2_1 molecule −0.5 ± 0.2 work distributions convergence plot
RUN296 ADA-UCB-6c2cb422-1_1 molecule EDJ-MED-c8e7a002-1_1 molecule −0.5 ± 0.2 work distributions convergence plot
RUN639 ADA-UCB-6c2cb422-1_1 molecule JIN-POS-6dc588a4-11_1 molecule −0.53 ± 0.10 work distributions convergence plot
RUN487 ADA-UCB-6c2cb422-1_1 molecule JOH-UNI-a38a7bdd-1_1 molecule −0.5 ± 0.2 work distributions convergence plot
RUN776 ADA-UCB-6c2cb422-1_1 molecule MAT-POS-8293a91a-6_2 molecule −0.5 ± 0.2 work distributions convergence plot
RUN390 ADA-UCB-6c2cb422-1_1 molecule MIC-UNK-5a93dd5f-3_1 molecule −0.5 ± 0.2 work distributions convergence plot
RUN462 ADA-UCB-6c2cb422-1_1 molecule NAU-LAT-4ce8bf23-2_1 molecule −0.5 ± 0.2 work distributions convergence plot
RUN762 ADA-UCB-6c2cb422-1_1 molecule MAT-POS-d8472c4f-2_2 molecule −0.5 ± 0.3 work distributions convergence plot
RUN738 ADA-UCB-6c2cb422-1_1 molecule PET-UNK-1320d94d-10_1 molecule −0.5 ± 0.3 work distributions convergence plot
RUN755 ADA-UCB-6c2cb422-1_1 molecule PET-UNK-ac320b15-10_1 molecule −0.4 ± 0.2 work distributions convergence plot
RUN689 ADA-UCB-6c2cb422-1_1 molecule ROB-UNI-daaf9793-3_1 molecule −0.4 ± 0.1 work distributions convergence plot
RUN415 ADA-UCB-6c2cb422-1_1 molecule MAK-UNK-ffc90da7-6_1 molecule −0.4 ± 0.2 work distributions convergence plot
RUN497 ADA-UCB-6c2cb422-1_1 molecule JOH-UNI-a38a7bdd-5_3 molecule −0.4 ± 0.2 work distributions convergence plot
RUN473 ADA-UCB-6c2cb422-1_1 molecule DAR-DIA-076fb6ea-9_2 molecule −0.4 ± 0.4 work distributions convergence plot
RUN601 ADA-UCB-6c2cb422-1_1 molecule EDJ-MED-ee07cf00-14_2 molecule −0.4 ± 0.2 work distributions convergence plot
RUN611 ADA-UCB-6c2cb422-1_1 molecule PET-UNK-e8c7a26f-2_1 molecule −0.4 ± 0.2 work distributions convergence plot
RUN785 ADA-UCB-6c2cb422-1_1 molecule MAT-POS-8293a91a-7_2 molecule −0.4 ± 0.2 work distributions convergence plot
RUN147 ADA-UCB-6c2cb422-1_1 molecule PET-UNK-bbe8d7ff-1_1 molecule −0.4 ± 0.2 work distributions convergence plot
RUN616 ADA-UCB-6c2cb422-1_1 molecule MAT-POS-a13804f0-1_1 molecule −0.4 ± 0.2 work distributions convergence plot
RUN478 ADA-UCB-6c2cb422-1_1 molecule DAR-DIA-076fb6ea-10_2 molecule −0.4 ± 0.2 work distributions convergence plot
RUN334 ADA-UCB-6c2cb422-1_1 molecule NAU-LAT-a5c7d7cb-6_2 molecule −0.4 ± 0.3 work distributions convergence plot
RUN389 ADA-UCB-6c2cb422-1_1 molecule MIC-UNK-5a93dd5f-3_3 molecule −0.3 ± 0.2 work distributions convergence plot
RUN731 ADA-UCB-6c2cb422-1_1 molecule PET-UNK-1320d94d-22_1 molecule −0.3 ± 0.2 work distributions convergence plot
RUN60 ADA-UCB-6c2cb422-1_1 molecule JAN-GHE-5a013bed-6_1 molecule −0.3 ± 0.1 work distributions convergence plot
RUN300 ADA-UCB-6c2cb422-1_1 molecule EDJ-MED-c8e7a002-4_1 molecule −0.3 ± 0.2 work distributions convergence plot
RUN402 ADA-UCB-6c2cb422-1_1 molecule MIC-UNK-5a93dd5f-3_13 molecule −0.3 ± 0.2 work distributions convergence plot
RUN453 ADA-UCB-6c2cb422-1_1 molecule NAU-LAT-2fed8305-1_1 molecule −0.30 ± 0.04 work distributions convergence plot
RUN609 ADA-UCB-6c2cb422-1_1 molecule EDJ-MED-ee07cf00-4_3 molecule −0.3 ± 0.2 work distributions convergence plot
RUN204 ADA-UCB-6c2cb422-1_1 molecule JAN-GHE-f4ca5a00-18_1 molecule −0.3 ± 0.2 work distributions convergence plot
RUN450 ADA-UCB-6c2cb422-1_1 molecule MIC-UNK-67d4a29a-4_1 molecule −0.3 ± 0.3 work distributions convergence plot
RUN797 ADA-UCB-6c2cb422-1_1 molecule MAT-POS-29385cc1-1_1 molecule −0.3 ± 0.1 work distributions convergence plot
RUN603 ADA-UCB-6c2cb422-1_1 molecule EDJ-MED-ee07cf00-17_2 molecule −0.2 ± 0.2 work distributions convergence plot
RUN391 ADA-UCB-6c2cb422-1_1 molecule MIC-UNK-5a93dd5f-3_14 molecule −0.2 ± 0.3 work distributions convergence plot
RUN577 ADA-UCB-6c2cb422-1_1 molecule EDJ-MED-ee07cf00-9_1 molecule −0.2 ± 0.2 work distributions convergence plot
RUN730 ADA-UCB-6c2cb422-1_1 molecule PET-UNK-1320d94d-4_1 molecule −0.2 ± 0.3 work distributions convergence plot
RUN537 ADA-UCB-6c2cb422-1_1 molecule JOH-UNI-3fc3434e-3_1 molecule −0.2 ± 0.1 work distributions convergence plot
RUN362 ADA-UCB-6c2cb422-1_1 molecule MAK-UNK-ffc90da7-5_1 molecule −0.2 ± 0.2 work distributions convergence plot
RUN795 ADA-UCB-6c2cb422-1_1 molecule MAT-POS-c0609ef7-1_1 molecule −0.2 ± 0.1 work distributions convergence plot
RUN564 ADA-UCB-6c2cb422-1_1 molecule EDJ-MED-ee07cf00-1_1 molecule −0.2 ± 0.2 work distributions convergence plot
RUN719 ADA-UCB-6c2cb422-1_1 molecule PET-UNK-158bee2a-2_1 molecule −0.2 ± 0.1 work distributions convergence plot
RUN338 ADA-UCB-6c2cb422-1_1 molecule MIC-UNK-50cce87d-2_1 molecule −0.2 ± 0.1 work distributions convergence plot
RUN571 ADA-UCB-6c2cb422-1_1 molecule EDJ-MED-ee07cf00-2_1 molecule −0.2 ± 0.2 work distributions convergence plot
RUN206 ADA-UCB-6c2cb422-1_1 molecule PET-UNK-8df914d1-1_1 molecule −0.2 ± 0.1 work distributions convergence plot
RUN140 ADA-UCB-6c2cb422-1_1 molecule SAM-UNK-2684b532-3_1 molecule −0.2 ± 0.1 work distributions convergence plot
RUN710 ADA-UCB-6c2cb422-1_1 molecule PET-UNK-e274cad4-1_1 molecule −0.2 ± 0.1 work distributions convergence plot
RUN715 ADA-UCB-6c2cb422-1_1 molecule PET-UNK-b1ef24dc-2_1 molecule −0.2 ± 0.1 work distributions convergence plot
RUN269 ADA-UCB-6c2cb422-1_1 molecule MAT-POS-f7918075-5_1 molecule −0.17 ± 0.02 work distributions convergence plot
RUN754 ADA-UCB-6c2cb422-1_1 molecule PET-UNK-ac320b15-3_1 molecule −0.2 ± 0.3 work distributions convergence plot
RUN794 ADA-UCB-6c2cb422-1_1 molecule MAT-POS-29385cc1-2_1 molecule −0.2 ± 0.1 work distributions convergence plot
RUN358 ADA-UCB-6c2cb422-1_1 molecule MIC-UNK-5a93dd5f-1_3 molecule −0.2 ± 0.2 work distributions convergence plot
RUN796 ADA-UCB-6c2cb422-1_1 molecule MAT-POS-29385cc1-4_1 molecule −0.2 ± 0.1 work distributions convergence plot
RUN270 ADA-UCB-6c2cb422-1_1 molecule MAT-POS-f7918075-7_1 molecule −0.2 ± 0.1 work distributions convergence plot
RUN587 ADA-UCB-6c2cb422-1_1 molecule EDJ-MED-ee07cf00-13_1 molecule −0.2 ± 0.2 work distributions convergence plot
RUN506 ADA-UCB-6c2cb422-1_1 molecule JOH-UNI-ee5ed7c8-3_1 molecule −0.1 ± 0.2 work distributions convergence plot
RUN708 ADA-UCB-6c2cb422-1_1 molecule PET-UNK-f4e47ebd-2_1 molecule −0.1 ± 0.1 work distributions convergence plot
RUN315 ADA-UCB-6c2cb422-1_1 molecule MAT-POS-199e2e7c-2_1 molecule −0.1 ± 0.1 work distributions convergence plot
RUN492 ADA-UCB-6c2cb422-1_1 molecule JOH-UNI-a38a7bdd-3_1 molecule −0.1 ± 0.1 work distributions convergence plot
RUN107 ADA-UCB-6c2cb422-1_1 molecule JAG-UCB-a3ef7265-10_1 molecule −0.1 ± 0.1 work distributions convergence plot
RUN340 ADA-UCB-6c2cb422-1_1 molecule MIC-UNK-50cce87d-3_1 molecule −0.08 ± 0.10 work distributions convergence plot
RUN157 ADA-UCB-6c2cb422-1_1 molecule JAN-GHE-f4ca5a00-14_1 molecule −0.1 ± 0.1 work distributions convergence plot
RUN591 ADA-UCB-6c2cb422-1_1 molecule EDJ-MED-ee07cf00-11_4 molecule −0.1 ± 0.2 work distributions convergence plot
RUN721 ADA-UCB-6c2cb422-1_1 molecule MIC-UNK-7574fcc6-1_1 molecule −0.1 ± 0.1 work distributions convergence plot
RUN521 ADA-UCB-6c2cb422-1_1 molecule DAR-DIA-56cf811e-3_1 molecule −0.0 ± 0.3 work distributions convergence plot
RUN597 ADA-UCB-6c2cb422-1_1 molecule EDJ-MED-ee07cf00-11_8 molecule −0.0 ± 0.2 work distributions convergence plot
RUN272 ADA-UCB-6c2cb422-1_1 molecule MAT-POS-1e5f28a7-1_1 molecule −0.0 ± 0.1 work distributions convergence plot
RUN255 ADA-UCB-6c2cb422-1_1 molecule MAT-POS-bb423b95-1_1 molecule 0.00 ± 0.03 work distributions convergence plot
RUN264 ADA-UCB-6c2cb422-1_1 molecule MAT-POS-f7918075-3_1 molecule 0.01 ± 0.04 work distributions convergence plot
RUN283 ADA-UCB-6c2cb422-1_1 molecule MIC-UNK-13557a72-1_2 molecule 0.0 ± 0.2 work distributions convergence plot
RUN647 ADA-UCB-6c2cb422-1_1 molecule RUB-POS-1325a9ea-1_1 molecule 0.0 ± 0.1 work distributions convergence plot
RUN585 ADA-UCB-6c2cb422-1_1 molecule EDJ-MED-ee07cf00-10_2 molecule 0.0 ± 0.2 work distributions convergence plot
RUN152 ADA-UCB-6c2cb422-1_1 molecule ADA-UCB-6c2cb422-1_1 molecule 0.02 ± 0.02 work distributions convergence plot
RUN189 ADA-UCB-6c2cb422-1_1 molecule EDJ-MED-00c1612e-1_1 molecule 0.0 ± 0.1 work distributions convergence plot
RUN344 ADA-UCB-6c2cb422-1_1 molecule MIC-UNK-50cce87d-1_1 molecule 0.03 ± 0.02 work distributions convergence plot
RUN352 ADA-UCB-6c2cb422-1_1 molecule MIC-UNK-5a93dd5f-2_1 molecule 0.0 ± 0.2 work distributions convergence plot
RUN649 ADA-UCB-6c2cb422-1_1 molecule RUB-POS-1325a9ea-3_1 molecule 0.06 ± 0.09 work distributions convergence plot
RUN376 ADA-UCB-6c2cb422-1_1 molecule MIC-UNK-5a93dd5f-3_2 molecule 0.1 ± 0.2 work distributions convergence plot
RUN360 ADA-UCB-6c2cb422-1_1 molecule MIC-UNK-5a93dd5f-1_5 molecule 0.1 ± 0.2 work distributions convergence plot
Last updated 2021-11-12T06:17:11.317694+00:00
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