COVID Moonshot Sprint 5
Summary
Compounds
Microstates
Transformations
(current)
Reliable transformations
Retrospective transformations
Transformations
Showing 2501 through 2600 of 5077
RUN
Initial microstate
Final microstate
ΔΔG / kcal M
-1
Work distribution
Convergence
RUN1993
PET-UNK-29afea89-2_1
sdf
pdb
RAL-THA-2d450e86-28_1
sdf
pdb
0.4
± 0.6
RUN1147
PET-UNK-29afea89-2_1
sdf
pdb
BEN-BAS-5c03e89e-2_2
sdf
pdb
0.4
± 0.3
RUN1290
PET-UNK-29afea89-2_1
sdf
pdb
RAL-THA-8416115c-11_3
sdf
pdb
0.4
± 0.3
RUN2366
PET-UNK-29afea89-2_1
sdf
pdb
EDG-MED-5d232de5-4_1
sdf
pdb
0.4
± 0.3
RUN3800
PET-UNK-29afea89-2_1
sdf
pdb
KAD-UNI-b13decd3-12_1
sdf
pdb
0.4
± 0.1
RUN1364
PET-UNK-29afea89-2_1
sdf
pdb
LON-WEI-5e7d1b3e-50_1
sdf
pdb
0.4
± 0.4
RUN4033
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-4223bc15-11_5
sdf
pdb
0.4
± 0.2
RUN2035
PET-UNK-29afea89-2_1
sdf
pdb
RAL-THA-05e671eb-15_2
sdf
pdb
0.4
± 0.5
RUN4341
PET-UNK-29afea89-2_1
sdf
pdb
RAL-THA-eb6cb89c-1_4
sdf
pdb
0.4
± 0.3
RUN2152
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-fce787c2-8_1
sdf
pdb
0.4
± 0.4
RUN3379
PET-UNK-29afea89-2_1
sdf
pdb
DAR-DIA-0587064e-22_2
sdf
pdb
0.4
± 0.2
RUN966
PET-UNK-29afea89-2_1
sdf
pdb
MAK-UNK-c749d764-15_11
sdf
pdb
0.4
± 0.6
RUN4828
PET-UNK-29afea89-2_1
sdf
pdb
EDJ-MED-015fb6b4-3_1
sdf
pdb
0.4
± 0.3
RUN588
PET-UNK-29afea89-2_1
sdf
pdb
MIC-UNK-bcd487e9-3_1
sdf
pdb
0.4
± 0.4
RUN1170
PET-UNK-29afea89-2_1
sdf
pdb
JOH-UNI-6fede743-2_1
sdf
pdb
0.4
± 0.4
RUN3925
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-96f51285-1_1
sdf
pdb
0.4
± 0.2
RUN4330
PET-UNK-29afea89-2_1
sdf
pdb
ALP-UNI-dbb9503d-2_1
sdf
pdb
0.4
± 0.2
RUN4877
PET-UNK-29afea89-2_1
sdf
pdb
ALP-POS-67d5babe-1_12
sdf
pdb
0.4
± 0.2
RUN3757
PET-UNK-29afea89-2_1
sdf
pdb
KAD-UNI-877d7bed-15_1
sdf
pdb
0.4
± 0.2
RUN4221
PET-UNK-29afea89-2_1
sdf
pdb
EDJ-MED-923a35c2-3_4
sdf
pdb
0.40
± 0.08
RUN4737
PET-UNK-29afea89-2_1
sdf
pdb
PET-UNK-d61f3ea6-2_1
sdf
pdb
0.4
± 0.2
RUN1473
PET-UNK-29afea89-2_1
sdf
pdb
EDG-MED-971238d3-8_1
sdf
pdb
0.4
± 0.4
RUN2955
PET-UNK-29afea89-2_1
sdf
pdb
ALP-UNI-8e43a71e-5_12
sdf
pdb
0.40
± 0.10
RUN2269
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-e9e99895-13_3
sdf
pdb
0.4
± 0.3
RUN1789
PET-UNK-29afea89-2_1
sdf
pdb
EDG-MED-90036822-86_1
sdf
pdb
0.4
± 0.3
RUN3917
PET-UNK-29afea89-2_1
sdf
pdb
PET-UNK-162c14b2-1_1
sdf
pdb
0.4
± 0.2
RUN3702
PET-UNK-29afea89-2_1
sdf
pdb
KAD-UNI-cb0f2bbc-19_1
sdf
pdb
0.4
± 0.2
RUN1331
PET-UNK-29afea89-2_1
sdf
pdb
LON-WEI-5e7d1b3e-31_1
sdf
pdb
0.4
± 0.4
RUN4404
PET-UNK-29afea89-2_1
sdf
pdb
PET-UNK-03fd2068-2_1
sdf
pdb
0.4
± 0.3
RUN3821
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-45b13633-2_2
sdf
pdb
0.4
± 0.2
RUN4240
PET-UNK-29afea89-2_1
sdf
pdb
ALP-POS-347519b5-1_17
sdf
pdb
0.41
± 0.07
RUN2523
PET-UNK-29afea89-2_1
sdf
pdb
ALP-UNI-3496895b-9_2
sdf
pdb
0.4
± 0.3
RUN1990
PET-UNK-29afea89-2_1
sdf
pdb
RAL-THA-2d450e86-26_1
sdf
pdb
0.4
± 0.5
RUN3927
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-96f51285-2_1
sdf
pdb
0.4
± 0.2
RUN4598
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-61f37a1a-6_1
sdf
pdb
0.4
± 0.3
RUN1871
PET-UNK-29afea89-2_1
sdf
pdb
MIC-UNK-a28eba03-1_2
sdf
pdb
0.4
± 0.5
RUN1918
PET-UNK-29afea89-2_1
sdf
pdb
JOH-UNI-3fc3434e-7_1
sdf
pdb
0.4
± 0.5
RUN3815
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-11ebe265-1_1
sdf
pdb
0.4
± 0.2
RUN3584
PET-UNK-29afea89-2_1
sdf
pdb
ALP-POS-6d96567b-1_2
sdf
pdb
0.4
± 0.5
RUN2009
PET-UNK-29afea89-2_1
sdf
pdb
RAL-THA-05e671eb-2_2
sdf
pdb
0.4
± 0.4
RUN3784
PET-UNK-29afea89-2_1
sdf
pdb
KAD-UNI-b13decd3-4_1
sdf
pdb
0.4
± 0.1
RUN3480
PET-UNK-29afea89-2_1
sdf
pdb
RAL-THA-e002e396-13_2
sdf
pdb
0.4
± 0.2
RUN3478
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-a13804f0-1_2
sdf
pdb
0.4
± 0.1
RUN3107
PET-UNK-29afea89-2_1
sdf
pdb
ALP-POS-fe871b40-2_1
sdf
pdb
0.4
± 0.2
RUN2125
PET-UNK-29afea89-2_1
sdf
pdb
KAD-UNI-8a629cb0-41_1
sdf
pdb
0.4
± 0.5
RUN1014
PET-UNK-29afea89-2_1
sdf
pdb
MAK-UNK-c749d764-21_1
sdf
pdb
0.4
± 0.5
RUN2671
PET-UNK-29afea89-2_1
sdf
pdb
EDG-MED-ba1ac7b9-14_6
sdf
pdb
0.4
± 0.3
RUN4663
PET-UNK-29afea89-2_1
sdf
pdb
MIC-UNK-89b52b17-2_1
sdf
pdb
0.4
± 0.2
RUN4700
PET-UNK-29afea89-2_1
sdf
pdb
EDJ-MED-1981ceba-5_4
sdf
pdb
0.4
± 0.3
RUN5069
PET-UNK-29afea89-2_1
sdf
pdb
MIC-UNK-06e5f114-4_3
sdf
pdb
0.4
± 0.4
RUN1000
PET-UNK-29afea89-2_1
sdf
pdb
MAK-UNK-c749d764-19_3
sdf
pdb
0.4
± 0.4
RUN1362
PET-UNK-29afea89-2_1
sdf
pdb
LON-WEI-5e7d1b3e-54_1
sdf
pdb
0.4
± 0.3
RUN4643
PET-UNK-29afea89-2_1
sdf
pdb
MIC-UNK-ea4eb352-5_2
sdf
pdb
0.4
± 0.2
RUN425
PET-UNK-29afea89-2_1
sdf
pdb
PET-UNK-dd44aeb6-2_1
sdf
pdb
0.4
± 0.2
RUN4469
PET-UNK-29afea89-2_1
sdf
pdb
EDJ-MED-1b5395f9-4_3
sdf
pdb
0.4
± 0.3
RUN761
PET-UNK-29afea89-2_1
sdf
pdb
MIC-UNK-5a93dd5f-5_4
sdf
pdb
0.4
± 0.1
RUN1864
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-281d2ee9-1_1
sdf
pdb
0.4
± 0.5
RUN1069
PET-UNK-29afea89-2_1
sdf
pdb
MAK-UNK-c749d764-31_2
sdf
pdb
0.4
± 0.4
RUN2859
PET-UNK-29afea89-2_1
sdf
pdb
ALF-EVA-650655fc-4_3
sdf
pdb
0.44
± 0.08
RUN1924
PET-UNK-29afea89-2_1
sdf
pdb
EDJ-MED-4c7486ba-1_1
sdf
pdb
0.4
± 0.4
RUN1658
PET-UNK-29afea89-2_1
sdf
pdb
EDG-MED-4c68219f-18_1
sdf
pdb
0.4
± 0.6
RUN4985
PET-UNK-29afea89-2_1
sdf
pdb
PET-UNK-1320d94d-15_1
sdf
pdb
0.4
± 0.3
RUN3874
PET-UNK-29afea89-2_1
sdf
pdb
EDJ-MED-670ad2ee-8_2
sdf
pdb
0.4
± 0.1
RUN4456
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-ec6d90b7-6_1
sdf
pdb
0.4
± 0.2
RUN1059
PET-UNK-29afea89-2_1
sdf
pdb
MAK-UNK-c749d764-28_6
sdf
pdb
0.4
± 0.3
RUN3843
PET-UNK-29afea89-2_1
sdf
pdb
EDJ-MED-841e0cf0-6_4
sdf
pdb
0.4
± 0.2
RUN2717
PET-UNK-29afea89-2_1
sdf
pdb
EDG-MED-ba1ac7b9-25_6
sdf
pdb
0.45
± 0.09
RUN1933
PET-UNK-29afea89-2_1
sdf
pdb
EDJ-MED-12c115cc-1_1
sdf
pdb
0.5
± 0.5
RUN1385
PET-UNK-29afea89-2_1
sdf
pdb
DAR-DIA-5ff57136-16_1
sdf
pdb
0.5
± 0.3
RUN438
PET-UNK-29afea89-2_1
sdf
pdb
RAL-THA-1d44ff04-4_1
sdf
pdb
0.5
± 0.4
RUN4368
PET-UNK-29afea89-2_1
sdf
pdb
BEN-DND-d1eb1f41-18_1
sdf
pdb
0.5
± 0.4
RUN1262
PET-UNK-29afea89-2_1
sdf
pdb
RAL-THA-8416115c-4_4
sdf
pdb
0.5
± 0.5
RUN1478
PET-UNK-29afea89-2_1
sdf
pdb
BEN-DND-a7517465-3_1
sdf
pdb
0.5
± 0.3
RUN4512
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-5f1400cf-1_7
sdf
pdb
0.5
± 0.3
RUN1937
PET-UNK-29afea89-2_1
sdf
pdb
EDJ-MED-4c7486ba-11_1
sdf
pdb
0.5
± 0.4
RUN5012
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-d8472c4f-3_1
sdf
pdb
0.5
± 0.2
RUN4775
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-24589f88-4_4
sdf
pdb
0.5
± 0.2
RUN3906
PET-UNK-29afea89-2_1
sdf
pdb
EDJ-MED-009f762b-1_1
sdf
pdb
0.5
± 0.2
RUN3979
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-4223bc15-2_4
sdf
pdb
0.5
± 0.2
RUN3124
PET-UNK-29afea89-2_1
sdf
pdb
ALP-POS-fe871b40-10_2
sdf
pdb
0.5
± 0.1
RUN4688
PET-UNK-29afea89-2_1
sdf
pdb
EDJ-MED-1981ceba-2_4
sdf
pdb
0.5
± 0.3
RUN3208
PET-UNK-29afea89-2_1
sdf
pdb
EDJ-MED-f893e2a1-8_1
sdf
pdb
0.5
± 0.2
RUN124
PET-UNK-29afea89-2_1
sdf
pdb
EDJ-MED-7320d5d2-1_1
sdf
pdb
0.5
± 0.2
RUN3190
PET-UNK-29afea89-2_1
sdf
pdb
VLA-UNK-3a43cd95-2_1
sdf
pdb
0.5
± 0.2
RUN1044
PET-UNK-29afea89-2_1
sdf
pdb
MAK-UNK-c749d764-26_1
sdf
pdb
0.5
± 0.6
RUN1612
PET-UNK-29afea89-2_1
sdf
pdb
ED_-GRI-5b13fbe2-66_1
sdf
pdb
0.5
± 0.4
RUN4563
PET-UNK-29afea89-2_1
sdf
pdb
ALP-POS-93b3621f-3_2
sdf
pdb
0.5
± 0.2
RUN1047
PET-UNK-29afea89-2_1
sdf
pdb
MAK-UNK-c749d764-26_2
sdf
pdb
0.5
± 0.4
RUN2998
PET-UNK-29afea89-2_1
sdf
pdb
ALP-UNI-8e43a71e-15_16
sdf
pdb
0.5
± 0.4
RUN3322
PET-UNK-29afea89-2_1
sdf
pdb
ROB-UNI-611831f5-2_1
sdf
pdb
0.5
± 0.1
RUN1787
PET-UNK-29afea89-2_1
sdf
pdb
EDG-MED-90036822-81_2
sdf
pdb
0.5
± 0.4
RUN3095
PET-UNK-29afea89-2_1
sdf
pdb
VLA-UNK-9a7dc93f-7_2
sdf
pdb
0.5
± 0.2
RUN4143
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-4223bc15-32_3
sdf
pdb
0.5
± 0.2
RUN4443
PET-UNK-29afea89-2_1
sdf
pdb
PET-UNK-9b23ef84-12_1
sdf
pdb
0.5
± 0.2
RUN321
PET-UNK-29afea89-2_1
sdf
pdb
VLA-UCB-05e51b3f-13_1
sdf
pdb
0.5
± 0.2
RUN3364
PET-UNK-29afea89-2_1
sdf
pdb
DAR-DIA-0587064e-14_2
sdf
pdb
0.47
± 0.07
RUN5053
PET-UNK-29afea89-2_1
sdf
pdb
ALP-POS-f1807566-1_2
sdf
pdb
0.5
± 0.2
RUN5056
PET-UNK-29afea89-2_1
sdf
pdb
ALP-POS-f1807566-3_1
sdf
pdb
0.5
± 0.3
RUN955
PET-UNK-29afea89-2_1
sdf
pdb
MAK-UNK-c749d764-12_8
sdf
pdb
0.5
± 0.4
RUN4287
PET-UNK-29afea89-2_1
sdf
pdb
ALP-POS-347519b5-2_40
sdf
pdb
0.5
± 0.3
Last updated 2021-06-04T18:13:56.580002+00:00
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