Transformations

Showing 1 through 100 of 3045
RUN Initial microstate Final microstate ΔΔG / kcal M-1 Work distribution Convergence
RUN949 MIC-UNK-91acba05-6_1 molecule amination-0000256_1_1 molecule −11.0 ± 0.2 work distributions convergence plot
RUN227 MIC-UNK-91acba05-6_1 molecule RAL-THA-05e671eb-3_1_1 molecule −9.9 ± 0.2 work distributions convergence plot
RUN1424 MIC-UNK-91acba05-6_1 molecule amination-0000646_1_1 molecule −9.7 ± 0.3 work distributions convergence plot
RUN932 MIC-UNK-91acba05-6_1 molecule amination-0000227_1_1 molecule −9.5 ± 0.2 work distributions convergence plot
RUN1418 MIC-UNK-91acba05-6_1 molecule amination-0000659_1_1 molecule −7.5 ± 0.5 work distributions convergence plot
RUN1359 MIC-UNK-91acba05-6_1 molecule amination-0000595_1_1 molecule −7.5 ± 0.2 work distributions convergence plot
RUN2900 MIC-UNK-91acba05-6_1 molecule amination-0001931_1_1 molecule −6.9 ± 0.3 work distributions convergence plot
RUN1507 MIC-UNK-91acba05-6_1 molecule amination-0000753_1_1 molecule −6.9 ± 0.2 work distributions convergence plot
RUN527 MIC-UNK-91acba05-6_1 molecule ROB-UNI-6ee2df8c-1_1_1 molecule −6.8 ± 0.3 work distributions convergence plot
RUN2838 MIC-UNK-91acba05-6_1 molecule amination-0001867_1_1 molecule −6.6 ± 0.2 work distributions convergence plot
RUN1353 MIC-UNK-91acba05-6_1 molecule amination-0000617_1_1 molecule −6.3 ± 0.2 work distributions convergence plot
RUN2760 MIC-UNK-91acba05-6_1 molecule amination-0001838_1_1 molecule −6.3 ± 0.2 work distributions convergence plot
RUN161 MIC-UNK-91acba05-6_1 molecule ALP-POS-966f8da6-1_1_1 molecule −6.1 ± 0.2 work distributions convergence plot
RUN2840 MIC-UNK-91acba05-6_1 molecule amination-0001893_1_1 molecule −6.0 ± 0.2 work distributions convergence plot
RUN68 MIC-UNK-91acba05-6_1 molecule ALP-UNI-44c99a80-3_1_1 molecule −6.0 ± 0.2 work distributions convergence plot
RUN162 MIC-UNK-91acba05-6_1 molecule BEN-DND-c852c98b-2_1_1 molecule −6.0 ± 0.2 work distributions convergence plot
RUN2763 MIC-UNK-91acba05-6_1 molecule amination-0001827_1_1 molecule −5.8 ± 0.2 work distributions convergence plot
RUN2694 MIC-UNK-91acba05-6_1 molecule amination-0001790_1_1 molecule −5.8 ± 0.2 work distributions convergence plot
RUN7 MIC-UNK-91acba05-6_1 molecule MAT-POS-8a69d52e-7_1_1 molecule −5.8 ± 0.2 work distributions convergence plot
RUN809 MIC-UNK-91acba05-6_1 molecule amination-0000157_1_1 molecule −5.6 ± 0.2 work distributions convergence plot
RUN2810 MIC-UNK-91acba05-6_1 molecule amination-0001849_1_1 molecule −5.5 ± 0.2 work distributions convergence plot
RUN16 MIC-UNK-91acba05-6_1 molecule EDJ-MED-e4b030d8-2_1_1 molecule −5.4 ± 0.2 work distributions convergence plot
RUN57 MIC-UNK-91acba05-6_1 molecule ADA-UCB-dc2b944c-16_1_1 molecule −5.4 ± 0.3 work distributions convergence plot
RUN166 MIC-UNK-91acba05-6_1 molecule MIC-UNK-45817b9b-1_1_1 molecule −5.4 ± 0.4 work distributions convergence plot
RUN2791 MIC-UNK-91acba05-6_1 molecule amination-0001838_1_1 molecule −5.4 ± 0.2 work distributions convergence plot
RUN2680 MIC-UNK-91acba05-6_1 molecule amination-0001757_1_1 molecule −5.0 ± 0.2 work distributions convergence plot
RUN1236 MIC-UNK-91acba05-6_1 molecule amination-0000472_1_1 molecule −4.9 ± 0.1 work distributions convergence plot
RUN247 MIC-UNK-91acba05-6_1 molecule RAL-THA-05e671eb-27_1_1 molecule −4.9 ± 0.2 work distributions convergence plot
RUN1368 MIC-UNK-91acba05-6_1 molecule amination-0000593_1_1 molecule −4.9 ± 0.2 work distributions convergence plot
RUN311 MIC-UNK-91acba05-6_1 molecule MAT-POS-78e1d523-1_1_1 molecule −4.8 ± 0.1 work distributions convergence plot
RUN350 MIC-UNK-91acba05-6_1 molecule MAT-POS-a13804f0-3_1_1 molecule −4.7 ± 0.4 work distributions convergence plot
RUN39 MIC-UNK-91acba05-6_1 molecule MIC-UNK-91acba05-2_1_1 molecule −4.7 ± 0.2 work distributions convergence plot
RUN216 MIC-UNK-91acba05-6_1 molecule RAL-THA-05e671eb-1_1_1 molecule −4.6 ± 0.3 work distributions convergence plot
RUN210 MIC-UNK-91acba05-6_1 molecule BEN-DND-a7517465-6_1_1 molecule −4.6 ± 0.2 work distributions convergence plot
RUN107 MIC-UNK-91acba05-6_1 molecule DAR-DIA-0d514e7d-12_1_1 molecule −4.5 ± 0.2 work distributions convergence plot
RUN1405 MIC-UNK-91acba05-6_1 molecule amination-0000663_1_1 molecule −4.5 ± 0.3 work distributions convergence plot
RUN844 MIC-UNK-91acba05-6_1 molecule amination-0000179_1_1 molecule −4.5 ± 0.4 work distributions convergence plot
RUN322 MIC-UNK-91acba05-6_1 molecule DAR-DIA-9e4459de-11_1_1 molecule −4.5 ± 0.2 work distributions convergence plot
RUN101 MIC-UNK-91acba05-6_1 molecule DAR-DIA-23e5a6a0-4_1_1 molecule −4.5 ± 0.2 work distributions convergence plot
RUN186 MIC-UNK-91acba05-6_1 molecule DAR-DIA-5ff57136-2_1_1 molecule −4.5 ± 0.5 work distributions convergence plot
RUN1380 MIC-UNK-91acba05-6_1 molecule amination-0000647_1_1 molecule −4.4 ± 0.2 work distributions convergence plot
RUN1481 MIC-UNK-91acba05-6_1 molecule amination-0000709_1_1 molecule −4.4 ± 0.3 work distributions convergence plot
RUN2759 MIC-UNK-91acba05-6_1 molecule amination-0001823_1_1 molecule −4.4 ± 0.2 work distributions convergence plot
RUN158 MIC-UNK-91acba05-6_1 molecule BEN-DND-c852c98b-6_1_1 molecule −4.4 ± 0.2 work distributions convergence plot
RUN75 MIC-UNK-91acba05-6_1 molecule DAR-DIA-0d514e7d-11_1_1 molecule −4.3 ± 0.2 work distributions convergence plot
RUN405 MIC-UNK-91acba05-6_1 molecule DAR-DIA-0587064e-18_1_1 molecule −4.2 ± 0.2 work distributions convergence plot
RUN220 MIC-UNK-91acba05-6_1 molecule BEN-DND-a7517465-5_1_1 molecule −4.2 ± 0.2 work distributions convergence plot
RUN242 MIC-UNK-91acba05-6_1 molecule ALP-UNI-3735e77e-3_1_1 molecule −4.2 ± 0.2 work distributions convergence plot
RUN1162 MIC-UNK-91acba05-6_1 molecule amination-0000413_1_1 molecule −4.1 ± 0.3 work distributions convergence plot
RUN9 MIC-UNK-91acba05-6_1 molecule MAT-POS-8a69d52e-4_1_1 molecule −4.1 ± 0.3 work distributions convergence plot
RUN215 MIC-UNK-91acba05-6_1 molecule BEN-DND-a7517465-1_1_1 molecule −4.1 ± 0.3 work distributions convergence plot
RUN194 MIC-UNK-91acba05-6_1 molecule DAR-DIA-5ff57136-17_1_1 molecule −4.0 ± 0.2 work distributions convergence plot
RUN2743 MIC-UNK-91acba05-6_1 molecule amination-0001810_1_1 molecule −4.0 ± 0.2 work distributions convergence plot
RUN154 MIC-UNK-91acba05-6_1 molecule MAK-UNK-83e0a0b4-3_1_1 molecule −3.9 ± 0.2 work distributions convergence plot
RUN480 MIC-UNK-91acba05-6_1 molecule KAD-UNI-877d7bed-3_1_1 molecule −3.9 ± 0.3 work distributions convergence plot
RUN653 MIC-UNK-91acba05-6_1 molecule amination-0000020_1_1 molecule −3.9 ± 0.3 work distributions convergence plot
RUN243 MIC-UNK-91acba05-6_1 molecule RAL-THA-05e671eb-24_1_1 molecule −3.9 ± 0.2 work distributions convergence plot
RUN716 MIC-UNK-91acba05-6_1 molecule MIC-UNK-54748b58-1_1_1 molecule −3.9 ± 0.5 work distributions convergence plot
RUN99 MIC-UNK-91acba05-6_1 molecule DAR-DIA-23e5a6a0-1_1_1 molecule −3.9 ± 0.2 work distributions convergence plot
RUN814 MIC-UNK-91acba05-6_1 molecule amination-0000154_1_1 molecule −3.9 ± 0.2 work distributions convergence plot
RUN56 MIC-UNK-91acba05-6_1 molecule ADA-UCB-dc2b944c-11_1_1 molecule −3.9 ± 0.2 work distributions convergence plot
RUN396 MIC-UNK-91acba05-6_1 molecule DAR-DIA-0587064e-26_1_1 molecule −3.8 ± 0.5 work distributions convergence plot
RUN281 MIC-UNK-91acba05-6_1 molecule DAR-DIA-5ff57136-19_1_1 molecule −3.8 ± 0.5 work distributions convergence plot
RUN509 MIC-UNK-91acba05-6_1 molecule PET-UNK-1b92fa34-4_1_1 molecule −3.8 ± 0.5 work distributions convergence plot
RUN2164 MIC-UNK-91acba05-6_1 molecule amination-0001277_1_1 molecule −3.8 ± 0.3 work distributions convergence plot
RUN2664 MIC-UNK-91acba05-6_1 molecule amination-0001745_1_1 molecule −3.7 ± 0.4 work distributions convergence plot
RUN701 MIC-UNK-91acba05-6_1 molecule amination-0000040_1_1 molecule −3.7 ± 0.2 work distributions convergence plot
RUN1640 MIC-UNK-91acba05-6_1 molecule amination-0000835_1_1 molecule −3.7 ± 0.2 work distributions convergence plot
RUN185 MIC-UNK-91acba05-6_1 molecule DAR-DIA-5ff57136-13_1_1 molecule −3.7 ± 0.2 work distributions convergence plot
RUN2790 MIC-UNK-91acba05-6_1 molecule amination-0001850_1_1 molecule −3.6 ± 0.2 work distributions convergence plot
RUN1431 MIC-UNK-91acba05-6_1 molecule amination-0000684_1_1 molecule −3.6 ± 0.2 work distributions convergence plot
RUN2800 MIC-UNK-91acba05-6_1 molecule amination-0001851_1_1 molecule −3.6 ± 0.2 work distributions convergence plot
RUN2877 MIC-UNK-91acba05-6_1 molecule amination-0001928_1_1 molecule −3.6 ± 0.2 work distributions convergence plot
RUN495 MIC-UNK-91acba05-6_1 molecule EDJ-MED-009f762b-4_1_1 molecule −3.5 ± 0.3 work distributions convergence plot
RUN441 MIC-UNK-91acba05-6_1 molecule KAD-UNI-877d7bed-1_1_1 molecule −3.5 ± 0.4 work distributions convergence plot
RUN93 MIC-UNK-91acba05-6_1 molecule DAR-DIA-0d514e7d-33_1_1 molecule −3.5 ± 0.3 work distributions convergence plot
RUN2482 MIC-UNK-91acba05-6_1 molecule amination-0001590_1_1 molecule −3.5 ± 0.3 work distributions convergence plot
RUN2647 MIC-UNK-91acba05-6_1 molecule amination-0001753_1_1 molecule −3.5 ± 0.4 work distributions convergence plot
RUN3017 MIC-UNK-91acba05-6_1 molecule amination-0001993_1_1 molecule −3.4 ± 0.1 work distributions convergence plot
RUN1087 MIC-UNK-91acba05-6_1 molecule amination-0000353_1_1 molecule −3.4 ± 0.2 work distributions convergence plot
RUN22 MIC-UNK-91acba05-6_1 molecule MIC-UNK-91acba05-6_2 molecule −3.4 ± 0.3 work distributions convergence plot
RUN535 MIC-UNK-91acba05-6_1 molecule MAT-POS-4223bc15-12_1_1 molecule −3.4 ± 0.3 work distributions convergence plot
RUN2912 MIC-UNK-91acba05-6_1 molecule amination-0001933_1_1 molecule −3.4 ± 0.2 work distributions convergence plot
RUN293 MIC-UNK-91acba05-6_1 molecule MAT-POS-f39f51fd-1_1_1 molecule −3.4 ± 0.4 work distributions convergence plot
RUN1662 MIC-UNK-91acba05-6_1 molecule amination-0000887_1_1 molecule −3.3 ± 0.2 work distributions convergence plot
RUN0 MIC-UNK-91acba05-6_1 molecule DAR-DIA-6a508060-3_1_1 molecule −3.3 ± 0.2 work distributions convergence plot
RUN1103 MIC-UNK-91acba05-6_1 molecule amination-0000385_1_1 molecule −3.3 ± 0.2 work distributions convergence plot
RUN13 MIC-UNK-91acba05-6_1 molecule EDJ-MED-e4b030d8-7_1_1 molecule −3.3 ± 0.2 work distributions convergence plot
RUN1381 MIC-UNK-91acba05-6_1 molecule amination-0000605_1_1 molecule −3.3 ± 0.2 work distributions convergence plot
RUN601 MIC-UNK-91acba05-6_1 molecule EDJ-MED-fa7708b3-2_1_1 molecule −3.3 ± 0.4 work distributions convergence plot
RUN599 MIC-UNK-91acba05-6_1 molecule EDJ-MED-fa7708b3-1_1_1 molecule −3.3 ± 0.3 work distributions convergence plot
RUN155 MIC-UNK-91acba05-6_1 molecule ALP-POS-966f8da6-2_1_1 molecule −3.3 ± 0.2 work distributions convergence plot
RUN379 MIC-UNK-91acba05-6_1 molecule DAR-DIA-0587064e-23_1_1 molecule −3.3 ± 0.4 work distributions convergence plot
RUN2462 MIC-UNK-91acba05-6_1 molecule amination-0001570_1_1 molecule −3.2 ± 0.4 work distributions convergence plot
RUN2379 MIC-UNK-91acba05-6_1 molecule amination-0001533_1_1 molecule −3.2 ± 0.4 work distributions convergence plot
RUN2532 MIC-UNK-91acba05-6_1 molecule amination-0001622_1_1 molecule −3.2 ± 0.4 work distributions convergence plot
RUN261 MIC-UNK-91acba05-6_1 molecule RAL-THA-05e671eb-21_1_1 molecule −3.2 ± 0.5 work distributions convergence plot
RUN455 MIC-UNK-91acba05-6_1 molecule EDJ-MED-670ad2ee-7_1_1 molecule −3.2 ± 0.3 work distributions convergence plot
RUN1506 MIC-UNK-91acba05-6_1 molecule amination-0000750_1_1 molecule −3.2 ± 0.2 work distributions convergence plot
RUN248 MIC-UNK-91acba05-6_1 molecule RAL-THA-05e671eb-19_1_1 molecule −3.2 ± 0.2 work distributions convergence plot
Last updated 2021-06-01T03:38:50.223398+00:00
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