COVID Moonshot Sprint 5
Summary
Compounds
Microstates
Transformations
(current)
Reliable transformations
Retrospective transformations
Transformations
Showing 6901 through 7000 of 7687
RUN
Initial microstate
Final microstate
ΔΔG / kcal M
-1
Work distribution
Convergence
RUN2342
MAT-POS-b3e365b9-1_1
sdf
pdb
ALP-UNI-3496895b-5_4
sdf
pdb
2.4
± 0.3
RUN2218
MAT-POS-b3e365b9-1_1
sdf
pdb
MAT-POS-f9802937-5_1
sdf
pdb
2.4
± 0.3
RUN1185
MAT-POS-b3e365b9-1_1
sdf
pdb
LON-WEI-5e7d1b3e-1_1
sdf
pdb
2.4
± 0.6
RUN2481
MAT-POS-b3e365b9-1_1
sdf
pdb
EDG-MED-ba1ac7b9-4_2
sdf
pdb
2.4
± 0.5
RUN6866
MAT-POS-b3e365b9-1_1
sdf
pdb
EN300-7459540_2_3_1
sdf
pdb
2.4
± 0.4
RUN126
MAT-POS-b3e365b9-1_1
sdf
pdb
ALP-POS-f13221e1-1_1
sdf
pdb
2.4
± 0.3
RUN7518
MAT-POS-b3e365b9-1_1
sdf
pdb
EN300-68882_2_1_1
sdf
pdb
2.4
± 0.3
RUN2555
MAT-POS-b3e365b9-1_1
sdf
pdb
EDG-MED-ba1ac7b9-33_2
sdf
pdb
2.4
± 0.5
RUN1381
MAT-POS-b3e365b9-1_1
sdf
pdb
DAR-DIA-9e4459de-15_14
sdf
pdb
2.4
± 0.5
RUN1173
MAT-POS-b3e365b9-1_1
sdf
pdb
RAL-THA-8416115c-5_4
sdf
pdb
2.4
± 0.3
RUN7416
MAT-POS-b3e365b9-1_1
sdf
pdb
EN300-6759972_2_2_1
sdf
pdb
2.4
± 0.3
RUN2370
MAT-POS-b3e365b9-1_1
sdf
pdb
ALP-UNI-3496895b-5_3
sdf
pdb
2.4
± 0.4
RUN338
MAT-POS-b3e365b9-1_1
sdf
pdb
FRA-DIA-c7e803f4-1_1
sdf
pdb
2.4
± 0.2
RUN1267
MAT-POS-b3e365b9-1_1
sdf
pdb
LON-WEI-5e7d1b3e-57_1
sdf
pdb
2.4
± 0.5
RUN699
MAT-POS-b3e365b9-1_1
sdf
pdb
MIC-UNK-5a93dd5f-7_3
sdf
pdb
2.4
± 0.4
RUN1852
MAT-POS-b3e365b9-1_1
sdf
pdb
RAL-THA-05e671eb-14_2
sdf
pdb
2.4
± 0.1
RUN444
MAT-POS-b3e365b9-1_1
sdf
pdb
MAK-UNK-8be7dca9-6_2
sdf
pdb
2.4
± 0.3
RUN1044
MAT-POS-b3e365b9-1_1
sdf
pdb
BEN-DND-f2e727cd-6_4
sdf
pdb
2.4
± 0.3
RUN2171
MAT-POS-b3e365b9-1_1
sdf
pdb
EDJ-MED-2f867453-2_1
sdf
pdb
2.4
± 0.3
RUN751
MAT-POS-b3e365b9-1_1
sdf
pdb
DAR-DIA-0d514e7d-32_8
sdf
pdb
2.4
± 0.3
RUN1089
MAT-POS-b3e365b9-1_1
sdf
pdb
MAK-UNK-c749d764-29_8
sdf
pdb
2.4
± 0.4
RUN1206
MAT-POS-b3e365b9-1_1
sdf
pdb
RAL-THA-8416115c-14_2
sdf
pdb
2.4
± 0.4
RUN710
MAT-POS-b3e365b9-1_1
sdf
pdb
MIC-UNK-5a93dd5f-10_2
sdf
pdb
2.4
± 0.4
RUN1245
MAT-POS-b3e365b9-1_1
sdf
pdb
DAR-DIA-5ff57136-1_1
sdf
pdb
2.4
± 0.7
RUN2589
MAT-POS-b3e365b9-1_1
sdf
pdb
ALF-EVA-ced740bd-4_1
sdf
pdb
2.4
± 0.2
RUN2317
MAT-POS-b3e365b9-1_1
sdf
pdb
ALP-UNI-0676e700-26_1
sdf
pdb
2.4
± 0.3
RUN831
MAT-POS-b3e365b9-1_1
sdf
pdb
MAK-UNK-c749d764-12_8
sdf
pdb
2.5
± 0.3
RUN2565
MAT-POS-b3e365b9-1_1
sdf
pdb
EDG-MED-ba1ac7b9-21_2
sdf
pdb
2.5
± 0.6
RUN6016
MAT-POS-b3e365b9-1_1
sdf
pdb
EN300-160277_2_1_1
sdf
pdb
2.5
± 0.2
RUN151
MAT-POS-b3e365b9-1_1
sdf
pdb
MIC-UNK-6ab519a7-1_2
sdf
pdb
2.5
± 0.5
RUN1289
MAT-POS-b3e365b9-1_1
sdf
pdb
ALP-POS-ce760d3f-1_2
sdf
pdb
2.5
± 0.3
RUN4806
MAT-POS-b3e365b9-1_1
sdf
pdb
EN300-126705_1_1_1
sdf
pdb
2.5
± 0.4
RUN6574
MAT-POS-b3e365b9-1_1
sdf
pdb
EN300-51801_3_1_1
sdf
pdb
2.5
± 0.3
RUN541
MAT-POS-b3e365b9-1_1
sdf
pdb
ADA-UCB-dc2b944c-14_1
sdf
pdb
2.5
± 0.3
RUN7555
MAT-POS-b3e365b9-1_1
sdf
pdb
EN300-746311_2_1_1
sdf
pdb
2.5
± 0.3
RUN1889
MAT-POS-b3e365b9-1_1
sdf
pdb
RAL-THA-05e671eb-23_1
sdf
pdb
2.5
± 0.3
RUN6285
MAT-POS-b3e365b9-1_1
sdf
pdb
EN300-19242_2_1_1
sdf
pdb
2.5
± 0.1
RUN3656
MAT-POS-b3e365b9-1_1
sdf
pdb
EN300-201346_2_1_1
sdf
pdb
2.5
± 0.2
RUN1056
MAT-POS-b3e365b9-1_1
sdf
pdb
JOH-SUS-a69c159d-2_2
sdf
pdb
2.5
± 0.3
RUN519
MAT-POS-b3e365b9-1_1
sdf
pdb
MIC-UNK-cdc2493e-20_1
sdf
pdb
2.5
± 0.5
RUN2497
MAT-POS-b3e365b9-1_1
sdf
pdb
EDG-MED-ba1ac7b9-19_2
sdf
pdb
2.5
± 0.3
RUN2058
MAT-POS-b3e365b9-1_1
sdf
pdb
LEE-CAM-7ab9b158-1_5
sdf
pdb
2.5
± 0.4
RUN1858
MAT-POS-b3e365b9-1_1
sdf
pdb
RAL-THA-05e671eb-1_1
sdf
pdb
2.51
± 0.07
RUN780
MAT-POS-b3e365b9-1_1
sdf
pdb
DAR-DIA-0d514e7d-34_1
sdf
pdb
2.5
± 0.3
RUN1077
MAT-POS-b3e365b9-1_1
sdf
pdb
MAK-UNK-c749d764-29_4
sdf
pdb
2.5
± 0.5
RUN691
MAT-POS-b3e365b9-1_1
sdf
pdb
MIC-UNK-5a93dd5f-3_15
sdf
pdb
2.5
± 0.4
RUN2745
MAT-POS-b3e365b9-1_1
sdf
pdb
EN300-39305_2_1_1
sdf
pdb
2.5
± 0.4
RUN1026
MAT-POS-b3e365b9-1_1
sdf
pdb
JOH-UNI-6fede743-3_1
sdf
pdb
2.5
± 0.3
RUN1968
MAT-POS-b3e365b9-1_1
sdf
pdb
KAD-UNI-8a629cb0-45_1
sdf
pdb
2.5
± 0.2
RUN7810
MAT-POS-b3e365b9-1_1
sdf
pdb
EN300-6737762_2_2_1
sdf
pdb
2.5
± 0.2
RUN214
MAT-POS-b3e365b9-1_1
sdf
pdb
LON-WEI-4d77710c-58_1
sdf
pdb
2.5
± 0.7
RUN7729
MAT-POS-b3e365b9-1_1
sdf
pdb
EN300-74856_1_2_1
sdf
pdb
2.5
± 0.3
RUN1021
MAT-POS-b3e365b9-1_1
sdf
pdb
JOH-SUS-a69c159d-1_2
sdf
pdb
2.5
± 0.3
RUN2055
MAT-POS-b3e365b9-1_1
sdf
pdb
MAT-POS-2905de8c-1_1
sdf
pdb
2.5
± 0.2
RUN2500
MAT-POS-b3e365b9-1_1
sdf
pdb
EDG-MED-ba1ac7b9-5_2
sdf
pdb
2.5
± 0.6
RUN870
MAT-POS-b3e365b9-1_1
sdf
pdb
MAK-UNK-c749d764-10_7
sdf
pdb
2.5
± 0.4
RUN303
MAT-POS-b3e365b9-1_1
sdf
pdb
MAT-POS-8a69d52e-5_1
sdf
pdb
2.5
± 0.3
RUN1136
MAT-POS-b3e365b9-1_1
sdf
pdb
BEN-DND-c852c98b-2_2
sdf
pdb
2.6
± 0.2
RUN4692
MAT-POS-b3e365b9-1_1
sdf
pdb
EN300-30687_2_1_1
sdf
pdb
2.6
± 0.2
RUN2355
MAT-POS-b3e365b9-1_1
sdf
pdb
ALP-UNI-3496895b-2_4
sdf
pdb
2.6
± 0.5
RUN1100
MAT-POS-b3e365b9-1_1
sdf
pdb
RAL-THA-8416115c-2_1
sdf
pdb
2.6
± 0.2
RUN1755
MAT-POS-b3e365b9-1_1
sdf
pdb
JOH-UNI-3fc3434e-10_1
sdf
pdb
2.6
± 0.4
RUN1292
MAT-POS-b3e365b9-1_1
sdf
pdb
EDG-MED-971238d3-4_1
sdf
pdb
2.6
± 0.2
RUN766
MAT-POS-b3e365b9-1_1
sdf
pdb
DAR-DIA-0d514e7d-32_4
sdf
pdb
2.6
± 0.3
RUN1848
MAT-POS-b3e365b9-1_1
sdf
pdb
RAL-THA-2d450e86-39_1
sdf
pdb
2.6
± 0.2
RUN1876
MAT-POS-b3e365b9-1_1
sdf
pdb
RAL-THA-05e671eb-2_2
sdf
pdb
2.6
± 0.3
RUN5693
MAT-POS-b3e365b9-1_1
sdf
pdb
EN300-181938_2_2_1
sdf
pdb
2.6
± 0.2
RUN908
MAT-POS-b3e365b9-1_1
sdf
pdb
MAK-UNK-c749d764-15_1
sdf
pdb
2.6
± 0.6
RUN1891
MAT-POS-b3e365b9-1_1
sdf
pdb
RAL-THA-05e671eb-26_2
sdf
pdb
2.6
± 0.2
RUN335
MAT-POS-b3e365b9-1_1
sdf
pdb
FRA-DIA-0fa076fe-1_1
sdf
pdb
2.6
± 0.2
RUN2665
MAT-POS-b3e365b9-1_1
sdf
pdb
EDJ-MED-8c98ee63-1_1
sdf
pdb
2.6
± 0.4
RUN4623
MAT-POS-b3e365b9-1_1
sdf
pdb
EN300-182725_4_3_1
sdf
pdb
2.6
± 0.4
RUN2554
MAT-POS-b3e365b9-1_1
sdf
pdb
EDG-MED-ba1ac7b9-22_2
sdf
pdb
2.6
± 0.4
RUN1751
MAT-POS-b3e365b9-1_1
sdf
pdb
EDJ-MED-12c115cc-2_1
sdf
pdb
2.6
± 0.3
RUN2257
MAT-POS-b3e365b9-1_1
sdf
pdb
ALP-UNI-0676e700-1_1
sdf
pdb
2.6
± 0.3
RUN103
MAT-POS-b3e365b9-1_1
sdf
pdb
MAT-POS-3b92565d-9_2
sdf
pdb
2.6
± 0.4
RUN5186
MAT-POS-b3e365b9-1_1
sdf
pdb
EN300-248883_2_2_1
sdf
pdb
2.6
± 0.2
RUN1887
MAT-POS-b3e365b9-1_1
sdf
pdb
RAL-THA-05e671eb-4_2
sdf
pdb
2.6
± 0.3
RUN1824
MAT-POS-b3e365b9-1_1
sdf
pdb
JOH-UNI-50ce7ec3-1_1
sdf
pdb
2.6
± 0.4
RUN1768
MAT-POS-b3e365b9-1_1
sdf
pdb
ALP-UNI-3735e77e-4_2
sdf
pdb
2.6
± 0.3
RUN4145
MAT-POS-b3e365b9-1_1
sdf
pdb
EN300-100180_2_2_1
sdf
pdb
2.6
± 0.4
RUN784
MAT-POS-b3e365b9-1_1
sdf
pdb
DAR-DIA-0d514e7d-32_26
sdf
pdb
2.6
± 0.3
RUN2660
MAT-POS-b3e365b9-1_1
sdf
pdb
EDJ-MED-8c98ee63-2_1
sdf
pdb
2.6
± 0.4
RUN7317
MAT-POS-b3e365b9-1_1
sdf
pdb
EN300-05798_2_1_1
sdf
pdb
2.6
± 0.2
RUN2250
MAT-POS-b3e365b9-1_1
sdf
pdb
ALP-POS-5bb456a5-2_4
sdf
pdb
2.6
± 0.5
RUN1129
MAT-POS-b3e365b9-1_1
sdf
pdb
RAL-THA-8416115c-2_2
sdf
pdb
2.6
± 0.3
RUN2561
MAT-POS-b3e365b9-1_1
sdf
pdb
EDG-MED-ba1ac7b9-28_4
sdf
pdb
2.6
± 0.5
RUN1860
MAT-POS-b3e365b9-1_1
sdf
pdb
RAL-THA-05e671eb-13_2
sdf
pdb
2.6
± 0.2
RUN467
MAT-POS-b3e365b9-1_1
sdf
pdb
MIC-UNK-cdc2493e-18_1
sdf
pdb
2.6
± 0.3
RUN1200
MAT-POS-b3e365b9-1_1
sdf
pdb
RAL-THA-8416115c-13_2
sdf
pdb
2.6
± 0.4
RUN352
MAT-POS-b3e365b9-1_1
sdf
pdb
RAL-THA-1d44ff04-10_1
sdf
pdb
2.6
± 0.4
RUN2512
MAT-POS-b3e365b9-1_1
sdf
pdb
EDG-MED-ba1ac7b9-12_4
sdf
pdb
2.6
± 0.7
RUN118
MAT-POS-b3e365b9-1_1
sdf
pdb
VLA-UCB-1dbca3b4-15_2
sdf
pdb
2.6
± 0.3
RUN769
MAT-POS-b3e365b9-1_1
sdf
pdb
DAR-DIA-0d514e7d-32_2
sdf
pdb
2.6
± 0.3
RUN1830
MAT-POS-b3e365b9-1_1
sdf
pdb
ALP-UNI-3735e77e-3_2
sdf
pdb
2.6
± 0.2
RUN1908
MAT-POS-b3e365b9-1_1
sdf
pdb
RAL-THA-05e671eb-9_2
sdf
pdb
2.7
± 0.3
RUN408
MAT-POS-b3e365b9-1_1
sdf
pdb
MIC-UNK-91acba05-6_2
sdf
pdb
2.7
± 0.3
RUN715
MAT-POS-b3e365b9-1_1
sdf
pdb
MIC-UNK-5a93dd5f-11_1
sdf
pdb
2.7
± 0.5
RUN7388
MAT-POS-b3e365b9-1_1
sdf
pdb
EN300-224665_2_2_1
sdf
pdb
2.7
± 0.4
RUN7606
MAT-POS-b3e365b9-1_1
sdf
pdb
EN300-383824_2_1_1
sdf
pdb
2.7
± 0.4
Last updated 2021-02-17T18:02:40.003401+00:00
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