Transformations

Showing 201 through 300 of 100
RUN Initial microstate Final microstate ΔΔG / kcal M-1 Work distribution Convergence
RUN432 ADA-UCB-6c2cb422-1_1 molecule MIC-UNK-5a93dd5f-7_5 molecule 0.1 ± 0.2 work distributions convergence plot
RUN168 ADA-UCB-6c2cb422-1_1 molecule ADA-UCB-6c2cb422-8_1 molecule 0.1 ± 0.3 work distributions convergence plot
RUN288 ADA-UCB-6c2cb422-1_1 molecule ALP-POS-8b8a49e1-6_1 molecule 0.1 ± 0.1 work distributions convergence plot
RUN769 ADA-UCB-6c2cb422-1_1 molecule PET-UNK-b38839dc-1_1 molecule 0.1 ± 0.1 work distributions convergence plot
RUN218 ADA-UCB-6c2cb422-1_1 molecule MIC-UNK-08cd9c58-1_1 molecule 0.10 ± 0.04 work distributions convergence plot
RUN200 ADA-UCB-6c2cb422-1_1 molecule JAN-GHE-f4ca5a00-19_2 molecule 0.1 ± 0.2 work distributions convergence plot
RUN480 ADA-UCB-6c2cb422-1_1 molecule DAR-DIA-076fb6ea-7_1 molecule 0.1 ± 0.2 work distributions convergence plot
RUN653 ADA-UCB-6c2cb422-1_1 molecule RUB-POS-1325a9ea-4_1 molecule 0.12 ± 0.09 work distributions convergence plot
RUN572 ADA-UCB-6c2cb422-1_1 molecule EDJ-MED-ee07cf00-3_1 molecule 0.1 ± 0.2 work distributions convergence plot
RUN624 ADA-UCB-6c2cb422-1_1 molecule MAT-POS-a13804f0-4_2 molecule 0.1 ± 0.2 work distributions convergence plot
RUN430 ADA-UCB-6c2cb422-1_1 molecule MIC-UNK-5a93dd5f-9_7 molecule 0.1 ± 0.2 work distributions convergence plot
RUN673 ADA-UCB-6c2cb422-1_1 molecule RUB-POS-1325a9ea-14_1 molecule 0.2 ± 0.1 work distributions convergence plot
RUN257 ADA-UCB-6c2cb422-1_1 molecule MAT-POS-bb423b95-7_1 molecule 0.2 ± 0.2 work distributions convergence plot
RUN655 ADA-UCB-6c2cb422-1_1 molecule RUB-POS-1325a9ea-2_1 molecule 0.16 ± 0.02 work distributions convergence plot
RUN387 ADA-UCB-6c2cb422-1_1 molecule MIC-UNK-5a93dd5f-3_9 molecule 0.2 ± 0.2 work distributions convergence plot
RUN19 ADA-UCB-6c2cb422-1_1 molecule JAN-GHE-83b26c96-6_2 molecule 0.2 ± 0.1 work distributions convergence plot
RUN349 ADA-UCB-6c2cb422-1_1 molecule MIC-UNK-5a93dd5f-2_5 molecule 0.2 ± 0.2 work distributions convergence plot
RUN734 ADA-UCB-6c2cb422-1_1 molecule PET-UNK-1320d94d-8_1 molecule 0.2 ± 0.2 work distributions convergence plot
RUN62 ADA-UCB-6c2cb422-1_1 molecule BAR-COM-ebf5acce-14_1 molecule 0.2 ± 0.2 work distributions convergence plot
RUN433 ADA-UCB-6c2cb422-1_1 molecule MIC-UNK-5a93dd5f-7_7 molecule 0.2 ± 0.2 work distributions convergence plot
RUN407 ADA-UCB-6c2cb422-1_1 molecule MAK-UNK-ffc90da7-6_2 molecule 0.2 ± 0.2 work distributions convergence plot
RUN214 ADA-UCB-6c2cb422-1_1 molecule MIC-UNK-8971c93c-1_1 molecule 0.2 ± 0.1 work distributions convergence plot
RUN744 ADA-UCB-6c2cb422-1_1 molecule PET-UNK-1320d94d-28_1 molecule 0.2 ± 0.2 work distributions convergence plot
RUN350 ADA-UCB-6c2cb422-1_1 molecule MIC-UNK-5a93dd5f-1_1 molecule 0.2 ± 0.2 work distributions convergence plot
RUN670 ADA-UCB-6c2cb422-1_1 molecule RUB-POS-1325a9ea-8_1 molecule 0.2 ± 0.1 work distributions convergence plot
RUN724 ADA-UCB-6c2cb422-1_1 molecule PET-UNK-10339a1d-1_1 molecule 0.2 ± 0.2 work distributions convergence plot
RUN661 ADA-UCB-6c2cb422-1_1 molecule RUB-POS-1325a9ea-12_1 molecule 0.2 ± 0.1 work distributions convergence plot
RUN395 ADA-UCB-6c2cb422-1_1 molecule MIC-UNK-5a93dd5f-3_12 molecule 0.2 ± 0.2 work distributions convergence plot
RUN79 ADA-UCB-6c2cb422-1_1 molecule BAR-COM-ebf5acce-2_1 molecule 0.2 ± 0.2 work distributions convergence plot
RUN144 ADA-UCB-6c2cb422-1_1 molecule ABI-SAT-4d06482b-2_1 molecule 0.2 ± 0.1 work distributions convergence plot
RUN720 ADA-UCB-6c2cb422-1_1 molecule PET-UNK-158bee2a-4_1 molecule 0.2 ± 0.1 work distributions convergence plot
RUN592 ADA-UCB-6c2cb422-1_1 molecule EDJ-MED-ee07cf00-11_6 molecule 0.2 ± 0.2 work distributions convergence plot
RUN640 ADA-UCB-6c2cb422-1_1 molecule JIN-POS-6dc588a4-13_1 molecule 0.25 ± 0.04 work distributions convergence plot
RUN139 ADA-UCB-6c2cb422-1_1 molecule SAM-UNK-2684b532-6_2 molecule 0.28 ± 0.08 work distributions convergence plot
RUN784 ADA-UCB-6c2cb422-1_1 molecule PET-UNK-d899bab6-3_1 molecule 0.3 ± 0.1 work distributions convergence plot
RUN596 ADA-UCB-6c2cb422-1_1 molecule EDJ-MED-ee07cf00-14_1 molecule 0.3 ± 0.3 work distributions convergence plot
RUN565 ADA-UCB-6c2cb422-1_1 molecule JOH-UNI-50ce7ec3-4_1 molecule 0.3 ± 0.4 work distributions convergence plot
RUN277 ADA-UCB-6c2cb422-1_1 molecule MAT-POS-14ad9fe9-1_1 molecule 0.3 ± 0.1 work distributions convergence plot
RUN589 ADA-UCB-6c2cb422-1_1 molecule EDJ-MED-ee07cf00-11_2 molecule 0.3 ± 0.2 work distributions convergence plot
RUN576 ADA-UCB-6c2cb422-1_1 molecule EDJ-MED-ee07cf00-8_2 molecule 0.3 ± 0.2 work distributions convergence plot
RUN479 ADA-UCB-6c2cb422-1_1 molecule MAK-UNK-c749d764-22_7 molecule 0.4 ± 0.3 work distributions convergence plot
RUN411 ADA-UCB-6c2cb422-1_1 molecule MIC-UNK-5a93dd5f-5_7 molecule 0.4 ± 0.3 work distributions convergence plot
RUN541 ADA-UCB-6c2cb422-1_1 molecule JOH-UNI-3fc3434e-8_1 molecule 0.4 ± 0.1 work distributions convergence plot
RUN268 ADA-UCB-6c2cb422-1_1 molecule MAT-POS-f7918075-4_1 molecule 0.4 ± 0.1 work distributions convergence plot
RUN555 ADA-UCB-6c2cb422-1_1 molecule RAL-THA-2d450e86-21_1 molecule 0.36 ± 0.08 work distributions convergence plot
RUN528 ADA-UCB-6c2cb422-1_1 molecule PET-UNK-6c2be958-1_1 molecule 0.4 ± 0.2 work distributions convergence plot
RUN178 ADA-UCB-6c2cb422-1_1 molecule MIC-UNK-fc94cdb5-1_2 molecule 0.4 ± 0.2 work distributions convergence plot
RUN557 ADA-UCB-6c2cb422-1_1 molecule RAL-THA-2d450e86-19_1 molecule 0.39 ± 0.04 work distributions convergence plot
RUN447 ADA-UCB-6c2cb422-1_1 molecule MIC-UNK-67d4a29a-1_1 molecule 0.4 ± 0.2 work distributions convergence plot
RUN540 ADA-UCB-6c2cb422-1_1 molecule JOH-UNI-3fc3434e-9_1 molecule 0.4 ± 0.3 work distributions convergence plot
RUN790 ADA-UCB-6c2cb422-1_1 molecule PET-UNK-d899bab6-2_1 molecule 0.4 ± 0.1 work distributions convergence plot
RUN677 ADA-UCB-6c2cb422-1_1 molecule RUB-POS-1325a9ea-15_1 molecule 0.4 ± 0.1 work distributions convergence plot
RUN431 ADA-UCB-6c2cb422-1_1 molecule MIC-UNK-5a93dd5f-7_6 molecule 0.4 ± 0.3 work distributions convergence plot
RUN299 ADA-UCB-6c2cb422-1_1 molecule VLA-UCB-05e51b3f-15_1 molecule 0.4 ± 0.2 work distributions convergence plot
RUN408 ADA-UCB-6c2cb422-1_1 molecule MAK-UNK-ffc90da7-1_4 molecule 0.4 ± 0.3 work distributions convergence plot
RUN704 ADA-UCB-6c2cb422-1_1 molecule VLA-UNK-4cf5aa07-2_1 molecule 0.47 ± 0.10 work distributions convergence plot
RUN712 ADA-UCB-6c2cb422-1_1 molecule PET-UNK-b1ef24dc-3_1 molecule 0.5 ± 0.1 work distributions convergence plot
RUN619 ADA-UCB-6c2cb422-1_1 molecule MAT-POS-a13804f0-1_4 molecule 0.5 ± 0.2 work distributions convergence plot
RUN551 ADA-UCB-6c2cb422-1_1 molecule RAL-THA-2d450e86-20_1 molecule 0.49 ± 0.05 work distributions convergence plot
RUN413 ADA-UCB-6c2cb422-1_1 molecule MAK-UNK-ffc90da7-1_3 molecule 0.5 ± 0.3 work distributions convergence plot
RUN726 ADA-UCB-6c2cb422-1_1 molecule EDJ-MED-cf4b0d25-5_1 molecule 0.5 ± 0.2 work distributions convergence plot
RUN243 ADA-UCB-6c2cb422-1_1 molecule MIC-UNK-d36ab305-4_1 molecule 0.5 ± 0.2 work distributions convergence plot
RUN570 ADA-UCB-6c2cb422-1_1 molecule JOH-UNI-50ce7ec3-5_1 molecule 0.5 ± 0.3 work distributions convergence plot
RUN90 ADA-UCB-6c2cb422-1_1 molecule TRY-UNI-9f475305-7_1 molecule 0.5 ± 0.2 work distributions convergence plot
RUN179 ADA-UCB-6c2cb422-1_1 molecule ADA-UCB-6c2cb422-9_1 molecule 0.5 ± 0.2 work distributions convergence plot
RUN279 ADA-UCB-6c2cb422-1_1 molecule MAT-POS-afd4d4fd-3_1 molecule 0.55 ± 0.05 work distributions convergence plot
RUN275 ADA-UCB-6c2cb422-1_1 molecule MAT-POS-afd4d4fd-1_1 molecule 0.56 ± 0.06 work distributions convergence plot
RUN190 ADA-UCB-6c2cb422-1_1 molecule MAT-POS-e1b5ac6b-1_1 molecule 0.6 ± 0.1 work distributions convergence plot
RUN429 ADA-UCB-6c2cb422-1_1 molecule MIC-UNK-5a93dd5f-9_8 molecule 0.6 ± 0.2 work distributions convergence plot
RUN182 ADA-UCB-6c2cb422-1_1 molecule ALP-POS-ddb41b15-9_2 molecule 0.6 ± 0.2 work distributions convergence plot
RUN503 ADA-UCB-6c2cb422-1_1 molecule JOH-UNI-ee5ed7c8-1_1 molecule 0.6 ± 0.1 work distributions convergence plot
RUN403 ADA-UCB-6c2cb422-1_1 molecule MIC-UNK-5a93dd5f-5_5 molecule 0.6 ± 0.3 work distributions convergence plot
RUN265 ADA-UCB-6c2cb422-1_1 molecule MAT-POS-bb423b95-9_1 molecule 0.63 ± 0.04 work distributions convergence plot
RUN699 ADA-UCB-6c2cb422-1_1 molecule PET-UNK-f92d7c0c-9_1 molecule 0.6 ± 0.1 work distributions convergence plot
RUN588 ADA-UCB-6c2cb422-1_1 molecule VLA-UNK-9a7dc93f-7_2 molecule 0.7 ± 0.1 work distributions convergence plot
RUN216 ADA-UCB-6c2cb422-1_1 molecule MIC-UNK-c66144cb-3_1 molecule 0.7 ± 0.2 work distributions convergence plot
RUN260 ADA-UCB-6c2cb422-1_1 molecule MAT-POS-bb423b95-2_1 molecule 0.68 ± 0.08 work distributions convergence plot
RUN154 ADA-UCB-6c2cb422-1_1 molecule MAK-UNK-f203cb68-3_2 molecule 0.7 ± 0.2 work distributions convergence plot
RUN580 ADA-UCB-6c2cb422-1_1 molecule EDJ-MED-ee07cf00-6_2 molecule 0.7 ± 0.2 work distributions convergence plot
RUN615 ADA-UCB-6c2cb422-1_1 molecule EDJ-MED-ee07cf00-12_2 molecule 0.7 ± 0.2 work distributions convergence plot
RUN412 ADA-UCB-6c2cb422-1_1 molecule MIC-UNK-5a93dd5f-5_8 molecule 0.7 ± 0.3 work distributions convergence plot
RUN714 ADA-UCB-6c2cb422-1_1 molecule PET-UNK-b1ef24dc-4_1 molecule 0.69 ± 0.09 work distributions convergence plot
RUN192 ADA-UCB-6c2cb422-1_1 molecule ALP-POS-3b848b35-4_1 molecule 0.7 ± 0.2 work distributions convergence plot
RUN621 ADA-UCB-6c2cb422-1_1 molecule EDJ-MED-cf4b0d25-4_1 molecule 0.7 ± 0.1 work distributions convergence plot
RUN363 ADA-UCB-6c2cb422-1_1 molecule MAK-UNK-ffc90da7-9_3 molecule 0.7 ± 0.2 work distributions convergence plot
RUN57 ADA-UCB-6c2cb422-1_1 molecule JAN-GHE-5a013bed-3_1 molecule 0.7 ± 0.2 work distributions convergence plot
RUN651 ADA-UCB-6c2cb422-1_1 molecule JIN-POS-6dc588a4-21_1 molecule 0.71 ± 0.08 work distributions convergence plot
RUN792 ADA-UCB-6c2cb422-1_1 molecule MAT-POS-29385cc1-3_1 molecule 0.7 ± 0.1 work distributions convergence plot
RUN45 ADA-UCB-6c2cb422-1_1 molecule JAN-GHE-5a013bed-10_1 molecule 0.72 ± 0.09 work distributions convergence plot
RUN654 ADA-UCB-6c2cb422-1_1 molecule JIN-POS-6dc588a4-22_1 molecule 0.72 ± 0.09 work distributions convergence plot
RUN151 ADA-UCB-6c2cb422-1_1 molecule MAK-UNK-f203cb68-18_1 molecule 0.7 ± 0.2 work distributions convergence plot
RUN484 ADA-UCB-6c2cb422-1_1 molecule MAK-UNK-c749d764-6_3 molecule 0.7 ± 0.3 work distributions convergence plot
RUN22 ADA-UCB-6c2cb422-1_1 molecule JAN-GHE-83b26c96-8_2 molecule 0.7 ± 0.2 work distributions convergence plot
RUN195 ADA-UCB-6c2cb422-1_1 molecule JAN-GHE-f4ca5a00-20_1 molecule 0.7 ± 0.2 work distributions convergence plot
RUN665 ADA-UCB-6c2cb422-1_1 molecule RUB-POS-1325a9ea-13_1 molecule 0.8 ± 0.1 work distributions convergence plot
RUN29 ADA-UCB-6c2cb422-1_1 molecule JAN-GHE-83b26c96-9_1 molecule 0.8 ± 0.1 work distributions convergence plot
RUN181 ADA-UCB-6c2cb422-1_1 molecule ALP-POS-3b848b35-3_1 molecule 0.8 ± 0.1 work distributions convergence plot
RUN59 ADA-UCB-6c2cb422-1_1 molecule JAN-GHE-5a013bed-5_1 molecule 0.8 ± 0.2 work distributions convergence plot
RUN643 ADA-UCB-6c2cb422-1_1 molecule JIN-POS-6dc588a4-24_1 molecule 0.8 ± 0.1 work distributions convergence plot
RUN287 ADA-UCB-6c2cb422-1_1 molecule ALP-POS-8b8a49e1-8_1 molecule 0.8 ± 0.3 work distributions convergence plot
Last updated 2021-11-12T06:17:11.317694+00:00
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