COVID Moonshot Sprint 5
Summary
Compounds
Microstates
Transformations
(current)
Reliable transformations
Retrospective transformations
Transformations
Showing 6601 through 6700 of 7687
RUN
Initial microstate
Final microstate
ΔΔG / kcal M
-1
Work distribution
Convergence
RUN113
MAT-POS-b3e365b9-1_1
sdf
pdb
MAT-POS-bb423b95-6_1
sdf
pdb
1.8
± 0.3
RUN1018
MAT-POS-b3e365b9-1_1
sdf
pdb
JOH-SUS-a69c159d-3_1
sdf
pdb
1.8
± 0.1
RUN1468
MAT-POS-b3e365b9-1_1
sdf
pdb
ED_-GRI-5b13fbe2-48_2
sdf
pdb
1.8
± 0.5
RUN425
MAT-POS-b3e365b9-1_1
sdf
pdb
MAK-UNK-8be7dca9-2_2
sdf
pdb
1.8
± 0.3
RUN1765
MAT-POS-b3e365b9-1_1
sdf
pdb
RAL-THA-2d450e86-5_1
sdf
pdb
1.8
± 0.3
RUN22
MAT-POS-b3e365b9-1_1
sdf
pdb
DAR-DIA-0cde14eb-58_1
sdf
pdb
1.8
± 0.4
RUN7496
MAT-POS-b3e365b9-1_1
sdf
pdb
EN300-18074_2_1_1
sdf
pdb
1.8
± 0.2
RUN405
MAT-POS-b3e365b9-1_1
sdf
pdb
DAR-DIA-5d6f1b43-12_1
sdf
pdb
1.8
± 0.4
RUN1769
MAT-POS-b3e365b9-1_1
sdf
pdb
EDG-MED-90036822-96_1
sdf
pdb
1.8
± 0.4
RUN6720
MAT-POS-b3e365b9-1_1
sdf
pdb
EN300-7433071_1_2_1
sdf
pdb
1.8
± 0.3
RUN7500
MAT-POS-b3e365b9-1_1
sdf
pdb
EN300-1689158_2_1_1
sdf
pdb
1.8
± 0.3
RUN2541
MAT-POS-b3e365b9-1_1
sdf
pdb
EDG-MED-ba1ac7b9-25_5
sdf
pdb
1.8
± 0.5
RUN2259
MAT-POS-b3e365b9-1_1
sdf
pdb
ALP-POS-2da19ca7-4_1
sdf
pdb
1.8
± 0.4
RUN2056
MAT-POS-b3e365b9-1_1
sdf
pdb
MAT-POS-2905de8c-3_1
sdf
pdb
1.8
± 0.5
RUN1831
MAT-POS-b3e365b9-1_1
sdf
pdb
NIR-THE-590dedc7-1_2
sdf
pdb
1.8
± 0.4
RUN5512
MAT-POS-b3e365b9-1_1
sdf
pdb
EN300-24014_1_2_1
sdf
pdb
1.8
± 0.4
RUN6967
MAT-POS-b3e365b9-1_1
sdf
pdb
EN300-303519_2_1_1
sdf
pdb
1.8
± 0.3
RUN57
MAT-POS-b3e365b9-1_1
sdf
pdb
MAT-POS-b5746674-37_1
sdf
pdb
1.8
± 0.5
RUN677
MAT-POS-b3e365b9-1_1
sdf
pdb
MIC-UNK-5a93dd5f-9_4
sdf
pdb
1.8
± 0.5
RUN690
MAT-POS-b3e365b9-1_1
sdf
pdb
MIC-UNK-5a93dd5f-7_6
sdf
pdb
1.8
± 0.5
RUN1624
MAT-POS-b3e365b9-1_1
sdf
pdb
EDG-MED-90036822-83_3
sdf
pdb
1.8
± 0.3
RUN1916
MAT-POS-b3e365b9-1_1
sdf
pdb
RAL-THA-05e671eb-27_2
sdf
pdb
1.9
± 0.3
RUN623
MAT-POS-b3e365b9-1_1
sdf
pdb
MAK-UNK-ffc90da7-9_7
sdf
pdb
1.9
± 0.4
RUN2125
MAT-POS-b3e365b9-1_1
sdf
pdb
LEE-CAM-7ab9b158-2_2
sdf
pdb
1.9
± 0.4
RUN6265
MAT-POS-b3e365b9-1_1
sdf
pdb
EN300-315854_2_2_1
sdf
pdb
1.9
± 0.4
RUN223
MAT-POS-b3e365b9-1_1
sdf
pdb
MAT-POS-afd4d4fd-2_1
sdf
pdb
1.9
± 0.4
RUN1098
MAT-POS-b3e365b9-1_1
sdf
pdb
ALP-POS-966f8da6-1_3
sdf
pdb
1.9
± 0.3
RUN2498
MAT-POS-b3e365b9-1_1
sdf
pdb
EDG-MED-ba1ac7b9-3_2
sdf
pdb
1.9
± 0.6
RUN6230
MAT-POS-b3e365b9-1_1
sdf
pdb
EN300-75030_2_1_1
sdf
pdb
1.9
± 0.3
RUN1985
MAT-POS-b3e365b9-1_1
sdf
pdb
MAT-POS-fce787c2-10_2
sdf
pdb
1.9
± 0.5
RUN1741
MAT-POS-b3e365b9-1_1
sdf
pdb
JOH-UNI-ee5ed7c8-5_1
sdf
pdb
1.9
± 0.3
RUN1501
MAT-POS-b3e365b9-1_1
sdf
pdb
ED_-GRI-5b13fbe2-52_2
sdf
pdb
1.9
± 0.4
RUN24
MAT-POS-b3e365b9-1_1
sdf
pdb
DAR-DIA-0cde14eb-57_2
sdf
pdb
1.9
± 0.3
RUN1738
MAT-POS-b3e365b9-1_1
sdf
pdb
JOH-UNI-3fc3434e-6_2
sdf
pdb
1.9
± 0.3
RUN5482
MAT-POS-b3e365b9-1_1
sdf
pdb
EN300-1716006_1_1_1
sdf
pdb
1.9
± 0.3
RUN7158
MAT-POS-b3e365b9-1_1
sdf
pdb
EN300-137243_2_1_1
sdf
pdb
1.9
± 0.2
RUN551
MAT-POS-b3e365b9-1_1
sdf
pdb
MIC-UNK-bcd487e9-6_1
sdf
pdb
1.9
± 0.6
RUN3411
MAT-POS-b3e365b9-1_1
sdf
pdb
NAU-LAT-b7d8c353-8_1_1
sdf
pdb
1.9
± 0.1
RUN50
MAT-POS-b3e365b9-1_1
sdf
pdb
VLA-UCB-1dbca3b4-6_1
sdf
pdb
1.9
± 0.3
RUN822
MAT-POS-b3e365b9-1_1
sdf
pdb
MAK-UNK-c749d764-4_3
sdf
pdb
1.9
± 0.3
RUN419
MAT-POS-b3e365b9-1_1
sdf
pdb
MAK-UNK-8be7dca9-5_2
sdf
pdb
1.9
± 0.4
RUN1913
MAT-POS-b3e365b9-1_1
sdf
pdb
RAL-THA-05e671eb-22_1
sdf
pdb
1.90
± 0.10
RUN7582
MAT-POS-b3e365b9-1_1
sdf
pdb
EN300-118760_4_1_1
sdf
pdb
1.9
± 0.4
RUN916
MAT-POS-b3e365b9-1_1
sdf
pdb
MAK-UNK-c749d764-15_11
sdf
pdb
1.9
± 0.5
RUN5622
MAT-POS-b3e365b9-1_1
sdf
pdb
EN300-6486793_2_1_1
sdf
pdb
1.9
± 0.3
RUN682
MAT-POS-b3e365b9-1_1
sdf
pdb
MAK-UNK-ffc90da7-4_5
sdf
pdb
1.9
± 0.6
RUN705
MAT-POS-b3e365b9-1_1
sdf
pdb
MIC-UNK-5a93dd5f-9_5
sdf
pdb
1.9
± 0.4
RUN7569
MAT-POS-b3e365b9-1_1
sdf
pdb
EN300-76387_1_1_1
sdf
pdb
1.9
± 0.3
RUN1729
MAT-POS-b3e365b9-1_1
sdf
pdb
JOH-UNI-ee5ed7c8-10_1
sdf
pdb
1.9
± 0.4
RUN7738
MAT-POS-b3e365b9-1_1
sdf
pdb
EN300-31845_2_1_1
sdf
pdb
1.9
± 0.2
RUN341
MAT-POS-b3e365b9-1_1
sdf
pdb
FRA-DIA-c7e803f4-1_2
sdf
pdb
1.9
± 0.2
RUN1844
MAT-POS-b3e365b9-1_1
sdf
pdb
RAL-THA-2d450e86-40_1
sdf
pdb
1.9
± 0.3
RUN2452
MAT-POS-b3e365b9-1_1
sdf
pdb
EDG-MED-ba1ac7b9-4_6
sdf
pdb
1.9
± 0.7
RUN834
MAT-POS-b3e365b9-1_1
sdf
pdb
MAK-UNK-c749d764-8_4
sdf
pdb
1.9
± 0.3
RUN4369
MAT-POS-b3e365b9-1_1
sdf
pdb
EN300-6792206_2_1_1
sdf
pdb
1.9
± 0.2
RUN819
MAT-POS-b3e365b9-1_1
sdf
pdb
MAK-UNK-c749d764-2_6
sdf
pdb
1.9
± 0.3
RUN7393
MAT-POS-b3e365b9-1_1
sdf
pdb
EN300-1590388_2_1_1
sdf
pdb
1.9
± 0.3
RUN1862
MAT-POS-b3e365b9-1_1
sdf
pdb
EDJ-MED-4c7486ba-1_1
sdf
pdb
1.9
± 0.3
RUN5018
MAT-POS-b3e365b9-1_1
sdf
pdb
EN300-31210_1_2_1
sdf
pdb
1.9
± 0.3
RUN829
MAT-POS-b3e365b9-1_1
sdf
pdb
MAK-UNK-c749d764-2_7
sdf
pdb
1.9
± 0.3
RUN494
MAT-POS-b3e365b9-1_1
sdf
pdb
NAU-LAT-a5c7d7cb-2_1
sdf
pdb
1.9
± 0.6
RUN6523
MAT-POS-b3e365b9-1_1
sdf
pdb
EN300-29617_1_1_2
sdf
pdb
1.9
± 0.7
RUN7607
MAT-POS-b3e365b9-1_1
sdf
pdb
EN300-187998_2_1_1
sdf
pdb
1.9
± 0.3
RUN805
MAT-POS-b3e365b9-1_1
sdf
pdb
MAK-UNK-c749d764-1_3
sdf
pdb
1.9
± 0.3
RUN7474
MAT-POS-b3e365b9-1_1
sdf
pdb
EN300-51735_2_1_1
sdf
pdb
1.9
± 0.3
RUN2045
MAT-POS-b3e365b9-1_1
sdf
pdb
CHO-MSK-a31cca77-1_2
sdf
pdb
1.9
± 0.4
RUN7544
MAT-POS-b3e365b9-1_1
sdf
pdb
EN300-99391_2_1_1
sdf
pdb
1.9
± 0.2
RUN6820
MAT-POS-b3e365b9-1_1
sdf
pdb
EN300-188915_1_2_1
sdf
pdb
1.9
± 0.3
RUN1914
MAT-POS-b3e365b9-1_1
sdf
pdb
RAL-THA-05e671eb-17_2
sdf
pdb
1.9
± 0.3
RUN194
MAT-POS-b3e365b9-1_1
sdf
pdb
LON-WEI-4d77710c-48_1
sdf
pdb
1.9
± 0.7
RUN2666
MAT-POS-b3e365b9-1_1
sdf
pdb
EDJ-MED-ee07cf00-5_2
sdf
pdb
1.9
± 0.4
RUN2683
MAT-POS-b3e365b9-1_1
sdf
pdb
EDJ-MED-ee07cf00-6_2
sdf
pdb
1.9
± 0.4
RUN6489
MAT-POS-b3e365b9-1_1
sdf
pdb
EN300-217494_1_2_1
sdf
pdb
1.9
± 0.3
RUN1881
MAT-POS-b3e365b9-1_1
sdf
pdb
RAL-THA-05e671eb-21_1
sdf
pdb
2.0
± 0.1
RUN6834
MAT-POS-b3e365b9-1_1
sdf
pdb
EN300-206646_2_1_1
sdf
pdb
2.0
± 0.3
RUN1115
MAT-POS-b3e365b9-1_1
sdf
pdb
RAL-THA-4aa06b95-3_1
sdf
pdb
2.0
± 0.3
RUN1066
MAT-POS-b3e365b9-1_1
sdf
pdb
JOH-UNI-f51e3bbc-3_1
sdf
pdb
2.0
± 0.1
RUN7734
MAT-POS-b3e365b9-1_1
sdf
pdb
EN300-51028_4_1_1
sdf
pdb
2.0
± 0.3
RUN7174
MAT-POS-b3e365b9-1_1
sdf
pdb
EN300-132615_1_1_1
sdf
pdb
2.0
± 0.3
RUN485
MAT-POS-b3e365b9-1_1
sdf
pdb
MIC-UNK-cdc2493e-22_1
sdf
pdb
2.0
± 0.4
RUN688
MAT-POS-b3e365b9-1_1
sdf
pdb
MIC-UNK-5a93dd5f-7_7
sdf
pdb
2.0
± 0.4
RUN5992
MAT-POS-b3e365b9-1_1
sdf
pdb
EN300-96544_1_1_1
sdf
pdb
2.0
± 0.2
RUN673
MAT-POS-b3e365b9-1_1
sdf
pdb
MAK-UNK-ffc90da7-9_4
sdf
pdb
2.0
± 0.4
RUN6891
MAT-POS-b3e365b9-1_1
sdf
pdb
EN300-100180_2_1_1
sdf
pdb
2.0
± 0.4
RUN262
MAT-POS-b3e365b9-1_1
sdf
pdb
MAT-POS-8e4737f4-1_1
sdf
pdb
2.0
± 0.3
RUN2501
MAT-POS-b3e365b9-1_1
sdf
pdb
EDG-MED-ba1ac7b9-9_2
sdf
pdb
2.0
± 0.6
RUN7033
MAT-POS-b3e365b9-1_1
sdf
pdb
EN300-114805_2_1_1
sdf
pdb
2.0
± 0.3
RUN1702
MAT-POS-b3e365b9-1_1
sdf
pdb
MAT-POS-281d2ee9-1_2
sdf
pdb
2.0
± 0.4
RUN2369
MAT-POS-b3e365b9-1_1
sdf
pdb
ALP-UNI-3496895b-15_5
sdf
pdb
2.0
± 0.3
RUN2151
MAT-POS-b3e365b9-1_1
sdf
pdb
EDJ-MED-9e38fd34-2_1
sdf
pdb
2.0
± 0.3
RUN934
MAT-POS-b3e365b9-1_1
sdf
pdb
MAK-UNK-c749d764-15_13
sdf
pdb
2.0
± 0.6
RUN4241
MAT-POS-b3e365b9-1_1
sdf
pdb
EN300-251396_1_2_1
sdf
pdb
2.0
± 0.5
RUN2515
MAT-POS-b3e365b9-1_1
sdf
pdb
EDG-MED-ba1ac7b9-18_1
sdf
pdb
2.0
± 0.4
RUN157
MAT-POS-b3e365b9-1_1
sdf
pdb
NIR-THE-d08c3b48-1_1
sdf
pdb
2.0
± 0.4
RUN7106
MAT-POS-b3e365b9-1_1
sdf
pdb
EN300-378373_2_1_1
sdf
pdb
2.0
± 0.1
RUN1290
MAT-POS-b3e365b9-1_1
sdf
pdb
DAR-DIA-5ff57136-19_1
sdf
pdb
2.0
± 0.3
RUN1785
MAT-POS-b3e365b9-1_1
sdf
pdb
MAT-POS-c7771779-2_1
sdf
pdb
2.0
± 0.4
RUN2289
MAT-POS-b3e365b9-1_1
sdf
pdb
ALP-POS-2da19ca7-1_1
sdf
pdb
2.0
± 0.4
RUN806
MAT-POS-b3e365b9-1_1
sdf
pdb
DAR-DIA-0d514e7d-32_22
sdf
pdb
2.0
± 0.3
RUN7583
MAT-POS-b3e365b9-1_1
sdf
pdb
EN300-6746326_1_2_1
sdf
pdb
2.0
± 0.3
Last updated 2021-02-17T18:02:40.003401+00:00
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