COVID Moonshot Sprint 10
Summary
Compounds
Microstates
Transformations
Reliable Transformations
(current)
Retrospective Transformations
Reliable Transformations
Showing 101 through 172 of 72
RUN
Initial microstate
Final microstate
ΔΔG / kcal M
-1
Work distribution
Convergence
RUN1174
ADA-UCB-6c2cb422-1_1
sdf
pdb
MIC-UNK-5a93dd5f-3_5
sdf
pdb
1.0
± 0.1
RUN1306
ADA-UCB-6c2cb422-1_1
sdf
pdb
JOH-UNI-a38a7bdd-6_3
sdf
pdb
1.1
± 0.2
RUN1378
ADA-UCB-6c2cb422-1_1
sdf
pdb
EDJ-MED-ee07cf00-6_1
sdf
pdb
1.1
± 0.2
RUN1490
ADA-UCB-6c2cb422-1_1
sdf
pdb
PET-UNK-f92d7c0c-2_1
sdf
pdb
1.1
± 0.2
RUN1089
ADA-UCB-6c2cb422-1_1
sdf
pdb
ALP-POS-8b8a49e1-5_2
sdf
pdb
1.2
± 0.2
RUN1199
ADA-UCB-6c2cb422-1_1
sdf
pdb
MIC-UNK-5a93dd5f-5_6
sdf
pdb
1.2
± 0.3
RUN1096
ADA-UCB-6c2cb422-1_1
sdf
pdb
EDJ-MED-c8e7a002-3_1
sdf
pdb
1.2
± 0.2
RUN1326
ADA-UCB-6c2cb422-1_1
sdf
pdb
DAR-DIA-076fb6ea-12_1
sdf
pdb
1.2
± 0.3
RUN919
ADA-UCB-6c2cb422-1_1
sdf
pdb
BAR-COM-0f94fc3d-38_2
sdf
pdb
1.3
± 0.2
RUN841
ADA-UCB-6c2cb422-1_1
sdf
pdb
TRY-UNI-2eddb1ff-5_1
sdf
pdb
1.3
± 0.1
RUN931
ADA-UCB-6c2cb422-1_1
sdf
pdb
MAK-UNK-6ca90168-23_1
sdf
pdb
1.31
± 0.10
RUN1209
ADA-UCB-6c2cb422-1_1
sdf
pdb
MAK-UNK-ffc90da7-4_7
sdf
pdb
1.3
± 0.3
RUN1122
ADA-UCB-6c2cb422-1_1
sdf
pdb
NAU-LAT-a5c7d7cb-13_1
sdf
pdb
1.3
± 0.2
RUN1097
ADA-UCB-6c2cb422-1_1
sdf
pdb
EDJ-MED-c8e7a002-2_1
sdf
pdb
1.4
± 0.2
RUN1402
ADA-UCB-6c2cb422-1_1
sdf
pdb
EDJ-MED-ee07cf00-17_2
sdf
pdb
1.4
± 0.2
RUN1002
ADA-UCB-6c2cb422-1_1
sdf
pdb
JAN-GHE-f4ca5a00-19_1
sdf
pdb
1.4
± 0.2
RUN805
ADA-UCB-6c2cb422-1_1
sdf
pdb
ADA-UNI-f8e79267-10_1
sdf
pdb
1.4
± 0.3
RUN1445
ADA-UCB-6c2cb422-1_1
sdf
pdb
JIN-POS-6dc588a4-9_1
sdf
pdb
1.4
± 0.1
RUN1468
ADA-UCB-6c2cb422-1_1
sdf
pdb
RUB-POS-1325a9ea-20_2
sdf
pdb
1.5
± 0.2
RUN1070
ADA-UCB-6c2cb422-1_1
sdf
pdb
MAT-POS-f7918075-8_1
sdf
pdb
1.54
± 0.09
RUN1129
ADA-UCB-6c2cb422-1_1
sdf
pdb
NAU-LAT-a5c7d7cb-2_2
sdf
pdb
1.6
± 0.1
RUN967
ADA-UCB-6c2cb422-1_1
sdf
pdb
ADA-UCB-6c2cb422-8_1
sdf
pdb
1.6
± 0.3
RUN1311
ADA-UCB-6c2cb422-1_1
sdf
pdb
JOH-UNI-ee5ed7c8-9_1
sdf
pdb
1.6
± 0.4
RUN1432
ADA-UCB-6c2cb422-1_1
sdf
pdb
JIN-POS-6dc588a4-4_1
sdf
pdb
1.65
± 0.09
RUN869
ADA-UCB-6c2cb422-1_1
sdf
pdb
EDG-MED-0da5ad92-12_1
sdf
pdb
1.7
± 0.1
RUN1274
ADA-UCB-6c2cb422-1_1
sdf
pdb
DAR-DIA-076fb6ea-10_1
sdf
pdb
1.7
± 0.2
RUN1205
ADA-UCB-6c2cb422-1_1
sdf
pdb
MAK-UNK-ffc90da7-9_7
sdf
pdb
1.7
± 0.2
RUN1284
ADA-UCB-6c2cb422-1_1
sdf
pdb
JOH-UNI-a38a7bdd-9_1
sdf
pdb
1.7
± 0.1
RUN862
ADA-UCB-6c2cb422-1_1
sdf
pdb
JAN-GHE-5a013bed-7_1
sdf
pdb
1.7
± 0.1
RUN1023
ADA-UCB-6c2cb422-1_1
sdf
pdb
MIC-UNK-8373f97b-4_3
sdf
pdb
1.7
± 0.1
RUN1085
ADA-UCB-6c2cb422-1_1
sdf
pdb
ALP-POS-8b8a49e1-5_1
sdf
pdb
1.7
± 0.2
RUN1079
ADA-UCB-6c2cb422-1_1
sdf
pdb
MAT-POS-500ca5bf-2_1
sdf
pdb
1.8
± 0.2
RUN1498
ADA-UCB-6c2cb422-1_1
sdf
pdb
PET-UNK-f92d7c0c-9_1
sdf
pdb
1.8
± 0.1
RUN1014
ADA-UCB-6c2cb422-1_1
sdf
pdb
PET-UNK-8df914d1-4_1
sdf
pdb
1.8
± 0.2
RUN1319
ADA-UCB-6c2cb422-1_1
sdf
pdb
JOH-UNI-ee5ed7c8-2_1
sdf
pdb
1.8
± 0.2
RUN915
ADA-UCB-6c2cb422-1_1
sdf
pdb
MAK-UNK-f203cb68-4_2
sdf
pdb
1.9
± 0.3
RUN1216
ADA-UCB-6c2cb422-1_1
sdf
pdb
MIC-UNK-5a93dd5f-6_2
sdf
pdb
1.9
± 0.2
RUN917
ADA-UCB-6c2cb422-1_1
sdf
pdb
MAK-UNK-f203cb68-14_1
sdf
pdb
1.9
± 0.3
RUN990
ADA-UCB-6c2cb422-1_1
sdf
pdb
EDJ-MED-a364e151-1_1
sdf
pdb
1.9
± 0.1
RUN1433
ADA-UCB-6c2cb422-1_1
sdf
pdb
JIN-POS-6dc588a4-14_1
sdf
pdb
1.9
± 0.1
RUN817
ADA-UCB-6c2cb422-1_1
sdf
pdb
JAN-GHE-83b26c96-2_2
sdf
pdb
1.9
± 0.2
RUN1034
ADA-UCB-6c2cb422-1_1
sdf
pdb
MIC-UNK-8373f97b-5_7
sdf
pdb
2.0
± 0.1
RUN975
ADA-UCB-6c2cb422-1_1
sdf
pdb
NAU-LAT-e1818702-10_1
sdf
pdb
2.0
± 0.1
RUN1298
ADA-UCB-6c2cb422-1_1
sdf
pdb
JOH-UNI-a38a7bdd-5_4
sdf
pdb
2.1
± 0.2
RUN1293
ADA-UCB-6c2cb422-1_1
sdf
pdb
JOH-UNI-a38a7bdd-6_1
sdf
pdb
2.1
± 0.3
RUN1344
ADA-UCB-6c2cb422-1_1
sdf
pdb
JOH-UNI-3fc3434e-13_1
sdf
pdb
2.1
± 0.2
RUN1088
ADA-UCB-6c2cb422-1_1
sdf
pdb
VLA-UCB-05e51b3f-17_1
sdf
pdb
2.1
± 0.1
RUN1435
ADA-UCB-6c2cb422-1_1
sdf
pdb
JIN-POS-6dc588a4-12_1
sdf
pdb
2.1
± 0.1
RUN852
ADA-UCB-6c2cb422-1_1
sdf
pdb
BAR-COM-ebf5acce-5_1
sdf
pdb
2.2
± 0.2
RUN1496
ADA-UCB-6c2cb422-1_1
sdf
pdb
PET-UNK-f92d7c0c-7_1
sdf
pdb
2.2
± 0.2
RUN1055
ADA-UCB-6c2cb422-1_1
sdf
pdb
MAT-POS-bb423b95-3_1
sdf
pdb
2.4
± 0.1
RUN1500
ADA-UCB-6c2cb422-1_1
sdf
pdb
PET-UNK-f92d7c0c-8_1
sdf
pdb
2.4
± 0.2
RUN1289
ADA-UCB-6c2cb422-1_1
sdf
pdb
JOH-UNI-a38a7bdd-9_3
sdf
pdb
2.5
± 0.1
RUN885
ADA-UCB-6c2cb422-1_1
sdf
pdb
EDJ-MED-49816e9b-5_1
sdf
pdb
2.6
± 0.2
RUN1271
ADA-UCB-6c2cb422-1_1
sdf
pdb
MAK-UNK-c749d764-22_3
sdf
pdb
2.7
± 0.4
RUN881
ADA-UCB-6c2cb422-1_1
sdf
pdb
BAR-COM-ebf5acce-10_1
sdf
pdb
2.8
± 0.3
RUN912
ADA-UCB-6c2cb422-1_1
sdf
pdb
MAK-UNK-f203cb68-12_2
sdf
pdb
2.8
± 0.4
RUN1431
ADA-UCB-6c2cb422-1_1
sdf
pdb
JIN-POS-6dc588a4-6_1
sdf
pdb
3.0
± 0.2
RUN1024
ADA-UCB-6c2cb422-1_1
sdf
pdb
MIC-UNK-8373f97b-4_4
sdf
pdb
3.1
± 0.2
RUN1292
ADA-UCB-6c2cb422-1_1
sdf
pdb
JOH-UNI-a38a7bdd-5_1
sdf
pdb
3.2
± 0.2
RUN1565
ADA-UCB-6c2cb422-1_1
sdf
pdb
EDJ-MED-6e43a462-8_1
sdf
pdb
3.2
± 0.2
RUN1456
ADA-UCB-6c2cb422-1_1
sdf
pdb
RUB-POS-1325a9ea-7_1
sdf
pdb
3.2
± 0.1
RUN1131
ADA-UCB-6c2cb422-1_1
sdf
pdb
ALP-UNI-44c99a80-1_1
sdf
pdb
3.3
± 0.2
RUN1301
ADA-UCB-6c2cb422-1_1
sdf
pdb
JOH-UNI-a38a7bdd-6_4
sdf
pdb
3.3
± 0.3
RUN921
ADA-UCB-6c2cb422-1_1
sdf
pdb
MAK-UNK-f203cb68-21_2
sdf
pdb
3.8
± 0.2
RUN1033
ADA-UCB-6c2cb422-1_1
sdf
pdb
MIC-UNK-8373f97b-4_7
sdf
pdb
3.8
± 0.2
RUN1361
ADA-UCB-6c2cb422-1_1
sdf
pdb
JOH-UNI-50ce7ec3-1_1
sdf
pdb
3.9
± 0.3
RUN1038
ADA-UCB-6c2cb422-1_1
sdf
pdb
VLA-UCB-1dbca3b4-1_2
sdf
pdb
4.1
± 0.1
RUN1107
ADA-UCB-6c2cb422-1_1
sdf
pdb
EDJ-MED-c8e7a002-10_1
sdf
pdb
5.8
± 0.1
RUN1347
ADA-UCB-6c2cb422-1_1
sdf
pdb
JOH-UNI-3fc3434e-7_1
sdf
pdb
6.0
± 0.2
RUN1587
ADA-UCB-6c2cb422-1_1
sdf
pdb
EDJ-MED-b24713dc-2_1
sdf
pdb
6.6
± 0.2
RUN1330
ADA-UCB-6c2cb422-1_1
sdf
pdb
JOH-UNI-ee5ed7c8-7_1
sdf
pdb
8.4
± 0.2
Last updated 2021-11-12T06:11:06.748777+00:00
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