Reliable Transformations

Showing 1 through 100 of 100
RUN Initial microstate Final microstate ΔΔG / kcal M-1 Work distribution Convergence
RUN1312 ADA-UCB-6c2cb422-1_1 molecule JOH-UNI-a38a7bdd-7_3 molecule −3.3 ± 0.2 work distributions convergence plot
RUN1393 ADA-UCB-6c2cb422-1_1 molecule EDJ-MED-ee07cf00-13_2 molecule −3.2 ± 0.2 work distributions convergence plot
RUN920 ADA-UCB-6c2cb422-1_1 molecule BAR-COM-0f94fc3d-24_1 molecule −2.8 ± 0.1 work distributions convergence plot
RUN1238 ADA-UCB-6c2cb422-1_1 molecule MIC-UNK-5a93dd5f-12_7 molecule −2.6 ± 0.1 work distributions convergence plot
RUN851 ADA-UCB-6c2cb422-1_1 molecule JAN-GHE-5a013bed-2_1 molecule −2.4 ± 0.1 work distributions convergence plot
RUN1377 ADA-UCB-6c2cb422-1_1 molecule EDJ-MED-ee07cf00-9_2 molecule −2.3 ± 0.2 work distributions convergence plot
RUN819 ADA-UCB-6c2cb422-1_1 molecule JAN-GHE-83b26c96-7_1 molecule −2.3 ± 0.2 work distributions convergence plot
RUN1020 ADA-UCB-6c2cb422-1_1 molecule MIC-UNK-c66144cb-3_2 molecule −2.3 ± 0.2 work distributions convergence plot
RUN1569 ADA-UCB-6c2cb422-1_1 molecule MAT-POS-8293a91a-7_1 molecule −2.1 ± 0.2 work distributions convergence plot
RUN1578 ADA-UCB-6c2cb422-1_1 molecule MAT-POS-8293a91a-6_1 molecule −2.0 ± 0.2 work distributions convergence plot
RUN993 ADA-UCB-6c2cb422-1_1 molecule ALP-POS-3b848b35-4_2 molecule −2.0 ± 0.2 work distributions convergence plot
RUN848 ADA-UCB-6c2cb422-1_1 molecule JAN-GHE-5a013bed-9_1 molecule −2.0 ± 0.1 work distributions convergence plot
RUN1001 ADA-UCB-6c2cb422-1_1 molecule JAN-GHE-f4ca5a00-20_2 molecule −2.0 ± 0.2 work distributions convergence plot
RUN1189 ADA-UCB-6c2cb422-1_1 molecule MIC-UNK-5a93dd5f-3_1 molecule −1.9 ± 0.1 work distributions convergence plot
RUN1000 ADA-UCB-6c2cb422-1_1 molecule JAN-GHE-f4ca5a00-18_2 molecule −1.8 ± 0.2 work distributions convergence plot
RUN1502 ADA-UCB-6c2cb422-1_1 molecule EDJ-MED-cf4b0d25-1_1 molecule −1.7 ± 0.2 work distributions convergence plot
RUN1253 ADA-UCB-6c2cb422-1_1 molecule MAK-UNK-c749d764-22_6 molecule −1.7 ± 0.2 work distributions convergence plot
RUN865 ADA-UCB-6c2cb422-1_1 molecule JAN-GHE-5a013bed-4_1 molecule −1.6 ± 0.1 work distributions convergence plot
RUN1484 ADA-UCB-6c2cb422-1_1 molecule VLA-UNK-411a133b-1_1 molecule −1.6 ± 0.1 work distributions convergence plot
RUN863 ADA-UCB-6c2cb422-1_1 molecule TRY-UNI-9f475305-3_2 molecule −1.6 ± 0.1 work distributions convergence plot
RUN1382 ADA-UCB-6c2cb422-1_1 molecule EDJ-MED-ee07cf00-6_4 molecule −1.6 ± 0.2 work distributions convergence plot
RUN944 ADA-UCB-6c2cb422-1_1 molecule SAM-UNK-2684b532-3_2 molecule −1.6 ± 0.1 work distributions convergence plot
RUN1263 ADA-UCB-6c2cb422-1_1 molecule DAR-DIA-076fb6ea-6_1 molecule −1.5 ± 0.2 work distributions convergence plot
RUN1192 ADA-UCB-6c2cb422-1_1 molecule MAK-UNK-ffc90da7-4_6 molecule −1.3 ± 0.2 work distributions convergence plot
RUN1555 ADA-UCB-6c2cb422-1_1 molecule PET-UNK-ac320b15-5_1 molecule −1.3 ± 0.2 work distributions convergence plot
RUN1409 ADA-UCB-6c2cb422-1_1 molecule EDJ-MED-ee07cf00-12_1 molecule −1.3 ± 0.2 work distributions convergence plot
RUN1204 ADA-UCB-6c2cb422-1_1 molecule MAK-UNK-ffc90da7-4_8 molecule −1.3 ± 0.3 work distributions convergence plot
RUN1281 ADA-UCB-6c2cb422-1_1 molecule MAK-UNK-c749d764-6_4 molecule −1.3 ± 0.3 work distributions convergence plot
RUN1501 ADA-UCB-6c2cb422-1_1 molecule PET-UNK-6314f867-3_1 molecule −1.3 ± 0.1 work distributions convergence plot
RUN1061 ADA-UCB-6c2cb422-1_1 molecule MAT-POS-bb423b95-8_1 molecule −1.3 ± 0.1 work distributions convergence plot
RUN1411 ADA-UCB-6c2cb422-1_1 molecule EDJ-MED-ee07cf00-4_4 molecule −1.2 ± 0.2 work distributions convergence plot
RUN1121 ADA-UCB-6c2cb422-1_1 molecule PET-UNK-5ecb6237-1_1 molecule −1.2 ± 0.2 work distributions convergence plot
RUN1334 ADA-UCB-6c2cb422-1_1 molecule JOH-UNI-ee5ed7c8-6_2 molecule −1.2 ± 0.1 work distributions convergence plot
RUN1366 ADA-UCB-6c2cb422-1_1 molecule EDJ-MED-ee07cf00-2_2 molecule −1.2 ± 0.2 work distributions convergence plot
RUN1394 ADA-UCB-6c2cb422-1_1 molecule EDJ-MED-ee07cf00-11_7 molecule −1.1 ± 0.2 work distributions convergence plot
RUN1365 ADA-UCB-6c2cb422-1_1 molecule EDJ-MED-ee07cf00-1_2 molecule −1.0 ± 0.2 work distributions convergence plot
RUN1488 ADA-UCB-6c2cb422-1_1 molecule ROB-UNI-daaf9793-3_1 molecule −0.9 ± 0.1 work distributions convergence plot
RUN1527 ADA-UCB-6c2cb422-1_1 molecule PET-UNK-1320d94d-7_1 molecule −0.9 ± 0.2 work distributions convergence plot
RUN1273 ADA-UCB-6c2cb422-1_1 molecule MAK-UNK-c749d764-22_8 molecule −0.8 ± 0.2 work distributions convergence plot
RUN1406 ADA-UCB-6c2cb422-1_1 molecule EDJ-MED-ee07cf00-5_1 molecule −0.7 ± 0.2 work distributions convergence plot
RUN1063 ADA-UCB-6c2cb422-1_1 molecule MAT-POS-f7918075-3_1 molecule −0.73 ± 0.04 work distributions convergence plot
RUN1327 ADA-UCB-6c2cb422-1_1 molecule PET-UNK-6c2be958-1_1 molecule −0.6 ± 0.2 work distributions convergence plot
RUN1504 ADA-UCB-6c2cb422-1_1 molecule EDJ-MED-cf4b0d25-1_2 molecule −0.6 ± 0.2 work distributions convergence plot
RUN1530 ADA-UCB-6c2cb422-1_1 molecule PET-UNK-1320d94d-22_1 molecule −0.6 ± 0.2 work distributions convergence plot
RUN1595 ADA-UCB-6c2cb422-1_1 molecule MAT-POS-29385cc1-4_1 molecule −0.53 ± 0.10 work distributions convergence plot
RUN939 ADA-UCB-6c2cb422-1_1 molecule SAM-UNK-2684b532-3_1 molecule −0.4 ± 0.2 work distributions convergence plot
RUN1539 ADA-UCB-6c2cb422-1_1 molecule PET-UNK-1320d94d-27_1 molecule −0.4 ± 0.2 work distributions convergence plot
RUN1544 ADA-UCB-6c2cb422-1_1 molecule PET-UNK-1320d94d-26_1 molecule −0.3 ± 0.2 work distributions convergence plot
RUN1191 ADA-UCB-6c2cb422-1_1 molecule MAK-UNK-ffc90da7-4_5 molecule −0.3 ± 0.3 work distributions convergence plot
RUN988 ADA-UCB-6c2cb422-1_1 molecule EDJ-MED-00c1612e-1_1 molecule −0.3 ± 0.1 work distributions convergence plot
RUN1242 ADA-UCB-6c2cb422-1_1 molecule MIC-UNK-5a93dd5f-12_3 molecule −0.3 ± 0.2 work distributions convergence plot
RUN1144 ADA-UCB-6c2cb422-1_1 molecule PET-UNK-a692de38-1_1 molecule −0.3 ± 0.2 work distributions convergence plot
RUN876 ADA-UCB-6c2cb422-1_1 molecule EDG-MED-0da5ad92-18_1 molecule −0.25 ± 0.08 work distributions convergence plot
RUN838 ADA-UCB-6c2cb422-1_1 molecule ALP-POS-95b75b4d-6_1 molecule −0.2 ± 0.1 work distributions convergence plot
RUN1353 ADA-UCB-6c2cb422-1_1 molecule RAL-THA-2d450e86-22_1 molecule −0.2 ± 0.1 work distributions convergence plot
RUN1506 ADA-UCB-6c2cb422-1_1 molecule PET-UNK-f4e47ebd-1_1 molecule −0.2 ± 0.1 work distributions convergence plot
RUN1252 ADA-UCB-6c2cb422-1_1 molecule NAU-LAT-2fed8305-1_1 molecule −0.16 ± 0.04 work distributions convergence plot
RUN1594 ADA-UCB-6c2cb422-1_1 molecule MAT-POS-c0609ef7-1_1 molecule −0.2 ± 0.1 work distributions convergence plot
RUN1363 ADA-UCB-6c2cb422-1_1 molecule EDJ-MED-ee07cf00-1_1 molecule −0.2 ± 0.2 work distributions convergence plot
RUN956 ADA-UCB-6c2cb422-1_1 molecule JAN-GHE-f4ca5a00-14_1 molecule −0.1 ± 0.1 work distributions convergence plot
RUN1157 ADA-UCB-6c2cb422-1_1 molecule MIC-UNK-5a93dd5f-1_3 molecule −0.1 ± 0.2 work distributions convergence plot
RUN1370 ADA-UCB-6c2cb422-1_1 molecule EDJ-MED-ee07cf00-2_1 molecule −0.1 ± 0.2 work distributions convergence plot
RUN1322 ADA-UCB-6c2cb422-1_1 molecule JOH-UNI-3fc3434e-1_1 molecule −0.0 ± 0.2 work distributions convergence plot
RUN951 ADA-UCB-6c2cb422-1_1 molecule ADA-UCB-6c2cb422-1_1 molecule −0.001 ± 0.008 work distributions convergence plot
RUN1454 ADA-UCB-6c2cb422-1_1 molecule RUB-POS-1325a9ea-2_1 molecule 0.02 ± 0.01 work distributions convergence plot
RUN928 ADA-UCB-6c2cb422-1_1 molecule SAM-UNK-2684b532-1_1 molecule 0.1 ± 0.1 work distributions convergence plot
RUN1439 ADA-UCB-6c2cb422-1_1 molecule JIN-POS-6dc588a4-13_1 molecule 0.08 ± 0.02 work distributions convergence plot
RUN1463 ADA-UCB-6c2cb422-1_1 molecule RUB-POS-1325a9ea-16_1 molecule 0.1 ± 0.1 work distributions convergence plot
RUN1472 ADA-UCB-6c2cb422-1_1 molecule RUB-POS-1325a9ea-14_1 molecule 0.2 ± 0.1 work distributions convergence plot
RUN1400 ADA-UCB-6c2cb422-1_1 molecule EDJ-MED-ee07cf00-14_2 molecule 0.2 ± 0.2 work distributions convergence plot
RUN1591 ADA-UCB-6c2cb422-1_1 molecule MAT-POS-29385cc1-3_1 molecule 0.2 ± 0.1 work distributions convergence plot
RUN1283 ADA-UCB-6c2cb422-1_1 molecule MAK-UNK-c749d764-6_3 molecule 0.3 ± 0.2 work distributions convergence plot
RUN1184 ADA-UCB-6c2cb422-1_1 molecule MIC-UNK-5a93dd5f-3_7 molecule 0.3 ± 0.3 work distributions convergence plot
RUN1171 ADA-UCB-6c2cb422-1_1 molecule MAK-UNK-ffc90da7-9_2 molecule 0.3 ± 0.2 work distributions convergence plot
RUN1186 ADA-UCB-6c2cb422-1_1 molecule MIC-UNK-5a93dd5f-3_9 molecule 0.3 ± 0.1 work distributions convergence plot
RUN1371 ADA-UCB-6c2cb422-1_1 molecule EDJ-MED-ee07cf00-3_1 molecule 0.4 ± 0.2 work distributions convergence plot
RUN1386 ADA-UCB-6c2cb422-1_1 molecule EDJ-MED-ee07cf00-13_1 molecule 0.4 ± 0.2 work distributions convergence plot
RUN1492 ADA-UCB-6c2cb422-1_1 molecule PET-UNK-f92d7c0c-1_1 molecule 0.4 ± 0.1 work distributions convergence plot
RUN1296 ADA-UCB-6c2cb422-1_1 molecule JOH-UNI-a38a7bdd-5_3 molecule 0.4 ± 0.2 work distributions convergence plot
RUN972 ADA-UCB-6c2cb422-1_1 molecule ALP-POS-3fc1724e-8_1 molecule 0.5 ± 0.3 work distributions convergence plot
RUN1230 ADA-UCB-6c2cb422-1_1 molecule MIC-UNK-5a93dd5f-7_6 molecule 0.5 ± 0.2 work distributions convergence plot
RUN1087 ADA-UCB-6c2cb422-1_1 molecule ALP-POS-8b8a49e1-6_1 molecule 0.6 ± 0.1 work distributions convergence plot
RUN1571 ADA-UCB-6c2cb422-1_1 molecule MAT-POS-8293a91a-2_2 molecule 0.6 ± 0.2 work distributions convergence plot
RUN1278 ADA-UCB-6c2cb422-1_1 molecule MAK-UNK-c749d764-22_7 molecule 0.6 ± 0.3 work distributions convergence plot
RUN946 ADA-UCB-6c2cb422-1_1 molecule PET-UNK-bbe8d7ff-1_1 molecule 0.7 ± 0.1 work distributions convergence plot
RUN999 ADA-UCB-6c2cb422-1_1 molecule JAN-GHE-f4ca5a00-19_2 molecule 0.7 ± 0.2 work distributions convergence plot
RUN980 ADA-UCB-6c2cb422-1_1 molecule ALP-POS-3b848b35-3_1 molecule 0.7 ± 0.1 work distributions convergence plot
RUN1582 ADA-UCB-6c2cb422-1_1 molecule PET-UNK-d899bab6-1_1 molecule 0.7 ± 0.1 work distributions convergence plot
RUN858 ADA-UCB-6c2cb422-1_1 molecule JAN-GHE-5a013bed-5_1 molecule 0.8 ± 0.2 work distributions convergence plot
RUN1304 ADA-UCB-6c2cb422-1_1 molecule DAR-DIA-076fb6ea-4_1 molecule 0.8 ± 0.2 work distributions convergence plot
RUN1229 ADA-UCB-6c2cb422-1_1 molecule MIC-UNK-5a93dd5f-9_7 molecule 0.8 ± 0.2 work distributions convergence plot
RUN884 ADA-UCB-6c2cb422-1_1 molecule BAR-COM-ebf5acce-15_1 molecule 0.8 ± 0.3 work distributions convergence plot
RUN1529 ADA-UCB-6c2cb422-1_1 molecule PET-UNK-1320d94d-4_1 molecule 0.9 ± 0.2 work distributions convergence plot
RUN818 ADA-UCB-6c2cb422-1_1 molecule JAN-GHE-83b26c96-6_2 molecule 0.9 ± 0.2 work distributions convergence plot
RUN1549 ADA-UCB-6c2cb422-1_1 molecule PET-UNK-1320d94d-24_1 molecule 0.9 ± 0.2 work distributions convergence plot
RUN1212 ADA-UCB-6c2cb422-1_1 molecule MAK-UNK-ffc90da7-1_3 molecule 0.9 ± 0.2 work distributions convergence plot
RUN1450 ADA-UCB-6c2cb422-1_1 molecule JIN-POS-6dc588a4-21_1 molecule 0.95 ± 0.07 work distributions convergence plot
RUN1146 ADA-UCB-6c2cb422-1_1 molecule MAK-UNK-ffc90da7-8_1 molecule 1.0 ± 0.1 work distributions convergence plot
RUN924 ADA-UCB-6c2cb422-1_1 molecule ANN-UNI-98d2bf15-3_1 molecule 1.0 ± 0.1 work distributions convergence plot
RUN843 ADA-UCB-6c2cb422-1_1 molecule ALP-POS-95b75b4d-7_1 molecule 1.0 ± 0.1 work distributions convergence plot
Last updated 2021-11-12T06:11:06.748777+00:00
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