COVID Moonshot Sprint 5
Summary
Compounds
Microstates
Transformations
(current)
Reliable transformations
Retrospective transformations
Transformations
Showing 7001 through 7100 of 7687
RUN
Initial microstate
Final microstate
ΔΔG / kcal M
-1
Work distribution
Convergence
RUN1087
MAT-POS-b3e365b9-1_1
sdf
pdb
BEN-DND-c852c98b-7_2
sdf
pdb
2.7
± 0.2
RUN7722
MAT-POS-b3e365b9-1_1
sdf
pdb
EN300-7438451_2_2_1
sdf
pdb
2.7
± 0.3
RUN2168
MAT-POS-b3e365b9-1_1
sdf
pdb
MAT-POS-e9e99895-13_2
sdf
pdb
2.7
± 0.5
RUN166
MAT-POS-b3e365b9-1_1
sdf
pdb
LON-WEI-4d77710c-31_1
sdf
pdb
2.7
± 0.4
RUN2579
MAT-POS-b3e365b9-1_1
sdf
pdb
ALF-EVA-ced740bd-3_2
sdf
pdb
2.7
± 0.2
RUN820
MAT-POS-b3e365b9-1_1
sdf
pdb
MAK-UNK-c749d764-1_4
sdf
pdb
2.7
± 0.3
RUN2082
MAT-POS-b3e365b9-1_1
sdf
pdb
MAT-POS-1f3f1a6f-2_1
sdf
pdb
2.7
± 0.3
RUN1230
MAT-POS-b3e365b9-1_1
sdf
pdb
LON-WEI-5e7d1b3e-27_1
sdf
pdb
2.7
± 0.4
RUN2214
MAT-POS-b3e365b9-1_1
sdf
pdb
MAT-POS-f9802937-9_1
sdf
pdb
2.7
± 0.3
RUN375
MAT-POS-b3e365b9-1_1
sdf
pdb
MIC-UNK-91acba05-4_2
sdf
pdb
2.7
± 0.3
RUN1384
MAT-POS-b3e365b9-1_1
sdf
pdb
DAR-DIA-9e4459de-13_12
sdf
pdb
2.7
± 0.5
RUN1113
MAT-POS-b3e365b9-1_1
sdf
pdb
RAL-THA-4aa06b95-2_2
sdf
pdb
2.7
± 0.4
RUN858
MAT-POS-b3e365b9-1_1
sdf
pdb
MAK-UNK-c749d764-3_3
sdf
pdb
2.7
± 0.5
RUN709
MAT-POS-b3e365b9-1_1
sdf
pdb
MIC-UNK-5a93dd5f-7_5
sdf
pdb
2.7
± 0.6
RUN1920
MAT-POS-b3e365b9-1_1
sdf
pdb
RAL-THA-05e671eb-34_1
sdf
pdb
2.70
± 0.09
RUN1897
MAT-POS-b3e365b9-1_1
sdf
pdb
RAL-THA-05e671eb-30_2
sdf
pdb
2.7
± 0.3
RUN0
MAT-POS-b3e365b9-1_1
sdf
pdb
LON-WEI-af038623-3_1
sdf
pdb
2.7
± 0.3
RUN656
MAT-POS-b3e365b9-1_1
sdf
pdb
MIC-UNK-5a93dd5f-5_3
sdf
pdb
2.7
± 0.4
RUN2326
MAT-POS-b3e365b9-1_1
sdf
pdb
ALP-POS-5bb456a5-9_1
sdf
pdb
2.7
± 0.5
RUN6232
MAT-POS-b3e365b9-1_1
sdf
pdb
EN300-158067_1_1_1
sdf
pdb
2.7
± 0.3
RUN753
MAT-POS-b3e365b9-1_1
sdf
pdb
DAR-DIA-0d514e7d-32_9
sdf
pdb
2.7
± 0.3
RUN1761
MAT-POS-b3e365b9-1_1
sdf
pdb
MAT-POS-c7771779-1_2
sdf
pdb
2.7
± 0.3
RUN4955
MAT-POS-b3e365b9-1_1
sdf
pdb
EN300-102853_2_1_1
sdf
pdb
2.7
± 0.2
RUN5946
MAT-POS-b3e365b9-1_1
sdf
pdb
EN300-7351945_2_2_1
sdf
pdb
2.7
± 0.4
RUN865
MAT-POS-b3e365b9-1_1
sdf
pdb
MAK-UNK-c749d764-5_3
sdf
pdb
2.7
± 0.4
RUN967
MAT-POS-b3e365b9-1_1
sdf
pdb
MAK-UNK-c749d764-25_3
sdf
pdb
2.7
± 0.4
RUN5578
MAT-POS-b3e365b9-1_1
sdf
pdb
EN300-1703825_2_1_1
sdf
pdb
2.7
± 0.4
RUN6415
MAT-POS-b3e365b9-1_1
sdf
pdb
EN300-259187_3_1_1
sdf
pdb
2.7
± 0.2
RUN5823
MAT-POS-b3e365b9-1_1
sdf
pdb
MAK-UNK-83e0a0b4-1_1_1
sdf
pdb
2.7
± 0.6
RUN1960
MAT-POS-b3e365b9-1_1
sdf
pdb
ALP-POS-d91e0300-1_2
sdf
pdb
2.7
± 0.2
RUN3188
MAT-POS-b3e365b9-1_1
sdf
pdb
EN300-72730_2_2_1
sdf
pdb
2.7
± 0.1
RUN638
MAT-POS-b3e365b9-1_1
sdf
pdb
MIC-UNK-5a93dd5f-3_3
sdf
pdb
2.7
± 0.4
RUN1760
MAT-POS-b3e365b9-1_1
sdf
pdb
RAL-THA-2d450e86-1_1
sdf
pdb
2.8
± 0.2
RUN1187
MAT-POS-b3e365b9-1_1
sdf
pdb
LON-WEI-5e7d1b3e-4_1
sdf
pdb
2.8
± 0.5
RUN62
MAT-POS-b3e365b9-1_1
sdf
pdb
MAT-POS-b5746674-104_1
sdf
pdb
2.8
± 0.5
RUN115
MAT-POS-b3e365b9-1_1
sdf
pdb
VLA-UCB-1dbca3b4-14_2
sdf
pdb
2.8
± 0.3
RUN208
MAT-POS-b3e365b9-1_1
sdf
pdb
MAT-POS-11b63608-1_2
sdf
pdb
2.8
± 0.2
RUN981
MAT-POS-b3e365b9-1_1
sdf
pdb
MAK-UNK-c749d764-22_7
sdf
pdb
2.8
± 0.4
RUN6497
MAT-POS-b3e365b9-1_1
sdf
pdb
EN300-71022_2_1_1
sdf
pdb
2.8
± 0.6
RUN681
MAT-POS-b3e365b9-1_1
sdf
pdb
MIC-UNK-5a93dd5f-7_4
sdf
pdb
2.8
± 0.5
RUN2346
MAT-POS-b3e365b9-1_1
sdf
pdb
ALP-UNI-3496895b-15_4
sdf
pdb
2.8
± 0.4
RUN6548
MAT-POS-b3e365b9-1_1
sdf
pdb
EN300-217107_4_1_1
sdf
pdb
2.8
± 0.2
RUN1912
MAT-POS-b3e365b9-1_1
sdf
pdb
RAL-THA-05e671eb-35_2
sdf
pdb
2.8
± 0.3
RUN6989
MAT-POS-b3e365b9-1_1
sdf
pdb
EN300-385132_1_1_3
sdf
pdb
2.8
± 0.5
RUN2230
MAT-POS-b3e365b9-1_1
sdf
pdb
KAD-UNI-80f122c8-1_2
sdf
pdb
2.8
± 0.5
RUN162
MAT-POS-b3e365b9-1_1
sdf
pdb
LON-WEI-4d77710c-30_1
sdf
pdb
2.8
± 0.7
RUN281
MAT-POS-b3e365b9-1_1
sdf
pdb
DAR-DIA-6a508060-5_4
sdf
pdb
2.8
± 0.4
RUN291
MAT-POS-b3e365b9-1_1
sdf
pdb
ALP-UNI-b33a865d-1_4
sdf
pdb
2.8
± 0.4
RUN2548
MAT-POS-b3e365b9-1_1
sdf
pdb
EDG-MED-ba1ac7b9-27_4
sdf
pdb
2.8
± 0.6
RUN6468
MAT-POS-b3e365b9-1_1
sdf
pdb
EN300-6497863_2_1_1
sdf
pdb
2.8
± 0.2
RUN1882
MAT-POS-b3e365b9-1_1
sdf
pdb
RAL-THA-05e671eb-22_2
sdf
pdb
2.8
± 0.2
RUN1193
MAT-POS-b3e365b9-1_1
sdf
pdb
RAL-THA-8416115c-13_4
sdf
pdb
2.8
± 0.4
RUN1164
MAT-POS-b3e365b9-1_1
sdf
pdb
RAL-THA-8416115c-5_2
sdf
pdb
2.8
± 0.4
RUN2507
MAT-POS-b3e365b9-1_1
sdf
pdb
EDG-MED-ba1ac7b9-14_2
sdf
pdb
2.8
± 0.4
RUN2587
MAT-POS-b3e365b9-1_1
sdf
pdb
EDG-MED-ba1ac7b9-25_2
sdf
pdb
2.8
± 0.6
RUN1178
MAT-POS-b3e365b9-1_1
sdf
pdb
RAL-THA-8416115c-12_1
sdf
pdb
2.8
± 0.3
RUN7753
MAT-POS-b3e365b9-1_1
sdf
pdb
EN300-02623_2_1_1
sdf
pdb
2.8
± 0.3
RUN4499
MAT-POS-b3e365b9-1_1
sdf
pdb
EN300-145616_4_1_1
sdf
pdb
2.8
± 0.3
RUN694
MAT-POS-b3e365b9-1_1
sdf
pdb
MIC-UNK-5a93dd5f-6_1
sdf
pdb
2.8
± 0.5
RUN382
MAT-POS-b3e365b9-1_1
sdf
pdb
MAK-UNK-919546f0-5_1
sdf
pdb
2.8
± 0.3
RUN1900
MAT-POS-b3e365b9-1_1
sdf
pdb
RAL-THA-05e671eb-32_2
sdf
pdb
2.8
± 0.3
RUN697
MAT-POS-b3e365b9-1_1
sdf
pdb
MIC-UNK-5a93dd5f-8_1
sdf
pdb
2.8
± 0.6
RUN7503
MAT-POS-b3e365b9-1_1
sdf
pdb
EN300-6489289_2_1_1
sdf
pdb
2.8
± 0.3
RUN2536
MAT-POS-b3e365b9-1_1
sdf
pdb
EDG-MED-ba1ac7b9-25_3
sdf
pdb
2.8
± 0.8
RUN264
MAT-POS-b3e365b9-1_1
sdf
pdb
LON-WEI-4d77710c-38_1
sdf
pdb
2.8
± 0.6
RUN1823
MAT-POS-b3e365b9-1_1
sdf
pdb
EDJ-MED-4c7486ba-2_1
sdf
pdb
2.8
± 0.2
RUN165
MAT-POS-b3e365b9-1_1
sdf
pdb
MIC-UNK-9582b2c5-3_1
sdf
pdb
2.8
± 0.4
RUN2699
MAT-POS-b3e365b9-1_1
sdf
pdb
EDJ-MED-8c98ee63-1_2
sdf
pdb
2.8
± 0.4
RUN7205
MAT-POS-b3e365b9-1_1
sdf
pdb
EN300-92406_2_1_1
sdf
pdb
2.8
± 0.2
RUN7354
MAT-POS-b3e365b9-1_1
sdf
pdb
EN300-00271_2_1_1
sdf
pdb
2.9
± 0.2
RUN119
MAT-POS-b3e365b9-1_1
sdf
pdb
MAT-POS-4211dce8-1_1
sdf
pdb
2.9
± 0.3
RUN1293
MAT-POS-b3e365b9-1_1
sdf
pdb
ALP-POS-ce760d3f-7_2
sdf
pdb
2.9
± 0.3
RUN2112
MAT-POS-b3e365b9-1_1
sdf
pdb
MAT-POS-e9e99895-10_2
sdf
pdb
2.9
± 0.3
RUN6367
MAT-POS-b3e365b9-1_1
sdf
pdb
EN300-52983_3_1_1
sdf
pdb
2.9
± 0.2
RUN1175
MAT-POS-b3e365b9-1_1
sdf
pdb
RAL-THA-8416115c-8_2
sdf
pdb
2.9
± 0.4
RUN1090
MAT-POS-b3e365b9-1_1
sdf
pdb
RAL-THA-4aa06b95-1_2
sdf
pdb
2.9
± 0.3
RUN1819
MAT-POS-b3e365b9-1_1
sdf
pdb
RAL-THA-2d450e86-37_1
sdf
pdb
2.9
± 0.2
RUN2484
MAT-POS-b3e365b9-1_1
sdf
pdb
EDG-MED-ba1ac7b9-15_7
sdf
pdb
2.9
± 0.7
RUN2019
MAT-POS-b3e365b9-1_1
sdf
pdb
CHO-MSK-a31cca77-2_1
sdf
pdb
2.9
± 0.4
RUN1203
MAT-POS-b3e365b9-1_1
sdf
pdb
RAL-THA-8416115c-11_2
sdf
pdb
2.9
± 0.4
RUN2625
MAT-POS-b3e365b9-1_1
sdf
pdb
EDG-MED-ba1ac7b9-31_4
sdf
pdb
2.9
± 0.4
RUN371
MAT-POS-b3e365b9-1_1
sdf
pdb
MAK-UNK-919546f0-2_2
sdf
pdb
2.9
± 0.3
RUN282
MAT-POS-b3e365b9-1_1
sdf
pdb
VLA-UCB-05e51b3f-4_1
sdf
pdb
2.9
± 0.4
RUN1134
MAT-POS-b3e365b9-1_1
sdf
pdb
RAL-THA-8416115c-1_2
sdf
pdb
2.9
± 0.3
RUN1892
MAT-POS-b3e365b9-1_1
sdf
pdb
RAL-THA-05e671eb-25_2
sdf
pdb
2.9
± 0.2
RUN1146
MAT-POS-b3e365b9-1_1
sdf
pdb
RAL-THA-8416115c-10_2
sdf
pdb
2.9
± 0.4
RUN757
MAT-POS-b3e365b9-1_1
sdf
pdb
DAR-DIA-0d514e7d-31_14
sdf
pdb
2.9
± 0.3
RUN1036
MAT-POS-b3e365b9-1_1
sdf
pdb
BEN-BAS-5c03e89e-1_4
sdf
pdb
2.9
± 0.3
RUN4834
MAT-POS-b3e365b9-1_1
sdf
pdb
EN300-36938_2_1_1
sdf
pdb
2.9
± 0.3
RUN986
MAT-POS-b3e365b9-1_1
sdf
pdb
MIC-UNK-67d4a29a-3_1
sdf
pdb
2.9
± 0.3
RUN1850
MAT-POS-b3e365b9-1_1
sdf
pdb
RAL-THA-05e671eb-3_2
sdf
pdb
2.9
± 0.3
RUN1324
MAT-POS-b3e365b9-1_1
sdf
pdb
JOH-UNI-a38a7bdd-5_3
sdf
pdb
2.9
± 0.4
RUN740
MAT-POS-b3e365b9-1_1
sdf
pdb
DAR-DIA-0d514e7d-31_15
sdf
pdb
3.0
± 0.3
RUN2066
MAT-POS-b3e365b9-1_1
sdf
pdb
MAT-POS-e9e99895-3_3
sdf
pdb
3.0
± 0.2
RUN695
MAT-POS-b3e365b9-1_1
sdf
pdb
MIC-UNK-5a93dd5f-4_2
sdf
pdb
3.0
± 0.4
RUN2237
MAT-POS-b3e365b9-1_1
sdf
pdb
ALP-POS-2da19ca7-5_1
sdf
pdb
3.0
± 0.3
RUN258
MAT-POS-b3e365b9-1_1
sdf
pdb
DAR-DIA-6a508060-8_2
sdf
pdb
3.0
± 0.3
RUN658
MAT-POS-b3e365b9-1_1
sdf
pdb
MIC-UNK-5a93dd5f-5_4
sdf
pdb
3.0
± 0.4
RUN2213
MAT-POS-b3e365b9-1_1
sdf
pdb
EDG-MED-5d232de5-2_1
sdf
pdb
3.0
± 0.2
RUN1395
MAT-POS-b3e365b9-1_1
sdf
pdb
DAR-DIA-9e4459de-11_16
sdf
pdb
3.0
± 0.5
Last updated 2021-02-17T18:02:40.003401+00:00
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