COVID Moonshot Sprint 5
Summary
Compounds
Microstates
Transformations
(current)
Reliable transformations
Retrospective transformations
Transformations
Showing 801 through 900 of 5077
RUN
Initial microstate
Final microstate
ΔΔG / kcal M
-1
Work distribution
Convergence
RUN3441
PET-UNK-29afea89-2_1
sdf
pdb
EDJ-MED-15e90dfc-3_1
sdf
pdb
−1.5
± 0.1
RUN1001
PET-UNK-29afea89-2_1
sdf
pdb
MAK-UNK-c749d764-19_4
sdf
pdb
−1.5
± 0.3
RUN733
PET-UNK-29afea89-2_1
sdf
pdb
MAK-UNK-83e0a0b4-1_2
sdf
pdb
−1.5
± 0.4
RUN2451
PET-UNK-29afea89-2_1
sdf
pdb
ALP-UNI-0676e700-9_1
sdf
pdb
−1.5
± 0.3
RUN259
PET-UNK-29afea89-2_1
sdf
pdb
MIC-UNK-9582b2c5-1_7
sdf
pdb
−1.5
± 0.4
RUN517
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-0c8fa4a7-1_1
sdf
pdb
−1.5
± 0.4
RUN3314
PET-UNK-29afea89-2_1
sdf
pdb
MIC-UNK-8758c41d-1_2
sdf
pdb
−1.5
± 0.2
RUN1411
PET-UNK-29afea89-2_1
sdf
pdb
DAR-DIA-9e4459de-11_3
sdf
pdb
−1.5
± 0.3
RUN625
PET-UNK-29afea89-2_1
sdf
pdb
JAG-UCB-706446eb-5_2
sdf
pdb
−1.5
± 0.2
RUN787
PET-UNK-29afea89-2_1
sdf
pdb
MIC-UNK-5a93dd5f-10_2
sdf
pdb
−1.5
± 0.3
RUN542
PET-UNK-29afea89-2_1
sdf
pdb
MIC-UNK-cdc2493e-8_7
sdf
pdb
−1.5
± 0.2
RUN2458
PET-UNK-29afea89-2_1
sdf
pdb
ALP-UNI-0676e700-14_1
sdf
pdb
−1.5
± 0.3
RUN1250
PET-UNK-29afea89-2_1
sdf
pdb
RAL-THA-8416115c-1_4
sdf
pdb
−1.5
± 0.3
RUN3323
PET-UNK-29afea89-2_1
sdf
pdb
ROB-UNI-611831f5-1_1
sdf
pdb
−1.5
± 0.1
RUN745
PET-UNK-29afea89-2_1
sdf
pdb
MIC-UNK-5a93dd5f-3_6
sdf
pdb
−1.5
± 0.3
RUN909
PET-UNK-29afea89-2_1
sdf
pdb
MAK-UNK-c749d764-3_5
sdf
pdb
−1.5
± 0.3
RUN550
PET-UNK-29afea89-2_1
sdf
pdb
MIC-UNK-cdc2493e-11_1
sdf
pdb
−1.5
± 0.3
RUN3399
PET-UNK-29afea89-2_1
sdf
pdb
DAR-DIA-b4e9dd8d-6_2
sdf
pdb
−1.5
± 0.2
RUN2500
PET-UNK-29afea89-2_1
sdf
pdb
ALP-UNI-3496895b-1_2
sdf
pdb
−1.5
± 0.4
RUN3684
PET-UNK-29afea89-2_1
sdf
pdb
KAD-UNI-cb0f2bbc-2_1
sdf
pdb
−1.4
± 0.1
RUN4236
PET-UNK-29afea89-2_1
sdf
pdb
ALP-POS-347519b5-1_13
sdf
pdb
−1.4
± 0.3
RUN1134
PET-UNK-29afea89-2_1
sdf
pdb
BEN-BAS-c2bc0d80-3_1
sdf
pdb
−1.4
± 0.5
RUN3123
PET-UNK-29afea89-2_1
sdf
pdb
ALP-POS-fe871b40-10_1
sdf
pdb
−1.4
± 0.2
RUN292
PET-UNK-29afea89-2_1
sdf
pdb
EDJ-MED-e4b030d8-12_1
sdf
pdb
−1.4
± 0.2
RUN2650
PET-UNK-29afea89-2_1
sdf
pdb
EDG-MED-ba1ac7b9-10_1
sdf
pdb
−1.4
± 0.5
RUN3415
PET-UNK-29afea89-2_1
sdf
pdb
DAR-DIA-f6ee7aeb-5_2
sdf
pdb
−1.4
± 0.2
RUN1517
PET-UNK-29afea89-2_1
sdf
pdb
MIC-UNK-08fa0751-2_1
sdf
pdb
−1.4
± 0.3
RUN298
PET-UNK-29afea89-2_1
sdf
pdb
ALP-POS-477dc5b7-2_2
sdf
pdb
−1.4
± 0.3
RUN1004
PET-UNK-29afea89-2_1
sdf
pdb
MAK-UNK-c749d764-19_7
sdf
pdb
−1.4
± 0.5
RUN3430
PET-UNK-29afea89-2_1
sdf
pdb
EDJ-MED-6d9ff7d0-4_1
sdf
pdb
−1.4
± 0.2
RUN1805
PET-UNK-29afea89-2_1
sdf
pdb
EDG-MED-90036822-94_2
sdf
pdb
−1.4
± 0.4
RUN300
PET-UNK-29afea89-2_1
sdf
pdb
ALP-POS-477dc5b7-4_1
sdf
pdb
−1.4
± 0.4
RUN3682
PET-UNK-29afea89-2_1
sdf
pdb
KAD-UNI-cb0f2bbc-1_2
sdf
pdb
−1.4
± 0.1
RUN657
PET-UNK-29afea89-2_1
sdf
pdb
PET-UNK-29afea89-1_1
sdf
pdb
−1.4
± 0.3
RUN1336
PET-UNK-29afea89-2_1
sdf
pdb
LON-WEI-5e7d1b3e-34_2
sdf
pdb
−1.4
± 0.3
RUN3458
PET-UNK-29afea89-2_1
sdf
pdb
EDJ-MED-15e90dfc-7_2
sdf
pdb
−1.4
± 0.4
RUN357
PET-UNK-29afea89-2_1
sdf
pdb
ALP-UNI-b33a865d-1_4
sdf
pdb
−1.4
± 0.4
RUN4304
PET-UNK-29afea89-2_1
sdf
pdb
ALP-POS-347519b5-3_21
sdf
pdb
−1.4
± 0.2
RUN4120
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-4223bc15-26_4
sdf
pdb
−1.4
± 0.2
RUN1430
PET-UNK-29afea89-2_1
sdf
pdb
DAR-DIA-9e4459de-13_6
sdf
pdb
−1.4
± 0.2
RUN609
PET-UNK-29afea89-2_1
sdf
pdb
ADA-UCB-dc2b944c-12_1
sdf
pdb
−1.4
± 0.3
RUN402
PET-UNK-29afea89-2_1
sdf
pdb
DAR-DIA-23e5a6a0-1_2
sdf
pdb
−1.4
± 0.2
RUN3369
PET-UNK-29afea89-2_1
sdf
pdb
DAR-DIA-0587064e-17_1
sdf
pdb
−1.4
± 0.2
RUN1091
PET-UNK-29afea89-2_1
sdf
pdb
ERI-UCB-d6de1f3c-2_1
sdf
pdb
−1.4
± 0.3
RUN1382
PET-UNK-29afea89-2_1
sdf
pdb
DAR-DIA-5ff57136-12_1
sdf
pdb
−1.4
± 0.2
RUN702
PET-UNK-29afea89-2_1
sdf
pdb
MAK-UNK-ffc90da7-5_1
sdf
pdb
−1.4
± 0.4
RUN638
PET-UNK-29afea89-2_1
sdf
pdb
VLA-UCB-34f3ed0c-10_1
sdf
pdb
−1.4
± 0.2
RUN3567
PET-UNK-29afea89-2_1
sdf
pdb
ALP-POS-e4f7337d-1_3
sdf
pdb
−1.4
± 0.2
RUN355
PET-UNK-29afea89-2_1
sdf
pdb
ALP-UNI-b33a865d-1_2
sdf
pdb
−1.4
± 0.2
RUN1604
PET-UNK-29afea89-2_1
sdf
pdb
ED_-GRI-5b13fbe2-57_1
sdf
pdb
−1.4
± 0.3
RUN773
PET-UNK-29afea89-2_1
sdf
pdb
MIC-UNK-5a93dd5f-7_6
sdf
pdb
−1.4
± 0.2
RUN1576
PET-UNK-29afea89-2_1
sdf
pdb
ED_-GRI-5b13fbe2-42_1
sdf
pdb
−1.4
± 0.6
RUN2341
PET-UNK-29afea89-2_1
sdf
pdb
EDJ-MED-d08626de-3_1
sdf
pdb
−1.4
± 0.2
RUN2094
PET-UNK-29afea89-2_1
sdf
pdb
KAD-UNI-8a629cb0-12_1
sdf
pdb
−1.4
± 0.4
RUN1199
PET-UNK-29afea89-2_1
sdf
pdb
BEN-DND-f2e727cd-6_2
sdf
pdb
−1.4
± 0.3
RUN1315
PET-UNK-29afea89-2_1
sdf
pdb
LON-WEI-5e7d1b3e-7_1
sdf
pdb
−1.4
± 0.3
RUN1500
PET-UNK-29afea89-2_1
sdf
pdb
LAU-MED-88a3970a-6_1
sdf
pdb
−1.4
± 0.2
RUN1030
PET-UNK-29afea89-2_1
sdf
pdb
MAK-UNK-c749d764-24_1
sdf
pdb
−1.4
± 0.3
RUN372
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-8a69d52e-5_1
sdf
pdb
−1.4
± 0.5
RUN399
PET-UNK-29afea89-2_1
sdf
pdb
FRA-DIA-b66f7109-4_1
sdf
pdb
−1.4
± 0.4
RUN575
PET-UNK-29afea89-2_1
sdf
pdb
MIC-UNK-cdc2493e-24_1
sdf
pdb
−1.4
± 0.4
RUN2104
PET-UNK-29afea89-2_1
sdf
pdb
KAD-UNI-8a629cb0-22_1
sdf
pdb
−1.4
± 0.4
RUN914
PET-UNK-29afea89-2_1
sdf
pdb
MAK-UNK-c749d764-4_2
sdf
pdb
−1.4
± 0.5
RUN515
PET-UNK-29afea89-2_1
sdf
pdb
DAR-DIA-2964957d-1_1
sdf
pdb
−1.4
± 0.6
RUN4641
PET-UNK-29afea89-2_1
sdf
pdb
MIC-UNK-ea4eb352-4_2
sdf
pdb
−1.4
± 0.2
RUN1097
PET-UNK-29afea89-2_1
sdf
pdb
ERI-UCB-d6de1f3c-6_1
sdf
pdb
−1.4
± 0.3
RUN2902
PET-UNK-29afea89-2_1
sdf
pdb
DAR-DIA-ecdbc7dd-15_2
sdf
pdb
−1.4
± 0.3
RUN2179
PET-UNK-29afea89-2_1
sdf
pdb
ALP-UNI-76695c4f-8_2
sdf
pdb
−1.4
± 0.4
RUN3623
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-5369c344-5_2
sdf
pdb
−1.39
± 0.07
RUN3792
PET-UNK-29afea89-2_1
sdf
pdb
KAD-UNI-b13decd3-7_1
sdf
pdb
−1.4
± 0.1
RUN897
PET-UNK-29afea89-2_1
sdf
pdb
MAK-UNK-c749d764-2_1
sdf
pdb
−1.4
± 0.5
RUN217
PET-UNK-29afea89-2_1
sdf
pdb
LON-WEI-4d77710c-34_2
sdf
pdb
−1.4
± 0.2
RUN2121
PET-UNK-29afea89-2_1
sdf
pdb
KAD-UNI-8a629cb0-39_1
sdf
pdb
−1.4
± 0.4
RUN3330
PET-UNK-29afea89-2_1
sdf
pdb
PET-UNK-bb7ffe78-3_1
sdf
pdb
−1.4
± 0.2
RUN2151
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-fce787c2-6_1
sdf
pdb
−1.4
± 0.4
RUN2240
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-e9e99895-2_6
sdf
pdb
−1.4
± 0.3
RUN2388
PET-UNK-29afea89-2_1
sdf
pdb
ALP-POS-2da19ca7-7_7
sdf
pdb
−1.4
± 0.5
RUN1584
PET-UNK-29afea89-2_1
sdf
pdb
ED_-GRI-5b13fbe2-45_1
sdf
pdb
−1.4
± 0.3
RUN3168
PET-UNK-29afea89-2_1
sdf
pdb
EDG-MED-70ae9412-2_2
sdf
pdb
−1.4
± 0.4
RUN371
PET-UNK-29afea89-2_1
sdf
pdb
EDJ-MED-50011917-1_2
sdf
pdb
−1.4
± 0.3
RUN1034
PET-UNK-29afea89-2_1
sdf
pdb
MAK-UNK-c749d764-24_5
sdf
pdb
−1.4
± 0.4
RUN4738
PET-UNK-29afea89-2_1
sdf
pdb
PET-UNK-d61f3ea6-2_2
sdf
pdb
−1.4
± 0.3
RUN994
PET-UNK-29afea89-2_1
sdf
pdb
MAK-UNK-c749d764-18_5
sdf
pdb
−1.4
± 0.4
RUN1350
PET-UNK-29afea89-2_1
sdf
pdb
LON-WEI-5e7d1b3e-43_1
sdf
pdb
−1.4
± 0.3
RUN859
PET-UNK-29afea89-2_1
sdf
pdb
DAR-DIA-0d514e7d-32_10
sdf
pdb
−1.4
± 0.2
RUN2673
PET-UNK-29afea89-2_1
sdf
pdb
EDG-MED-ba1ac7b9-14_8
sdf
pdb
−1.4
± 0.4
RUN4918
PET-UNK-29afea89-2_1
sdf
pdb
ALF-EVA-07677224-4_11
sdf
pdb
−1.4
± 0.3
RUN608
PET-UNK-29afea89-2_1
sdf
pdb
ADA-UCB-dc2b944c-10_1
sdf
pdb
−1.4
± 0.2
RUN2465
PET-UNK-29afea89-2_1
sdf
pdb
ALP-UNI-0676e700-19_1
sdf
pdb
−1.4
± 0.3
RUN1311
PET-UNK-29afea89-2_1
sdf
pdb
LON-WEI-5e7d1b3e-4_1
sdf
pdb
−1.4
± 0.2
RUN1144
PET-UNK-29afea89-2_1
sdf
pdb
BEN-BAS-5c03e89e-2_1
sdf
pdb
−1.4
± 0.3
RUN2559
PET-UNK-29afea89-2_1
sdf
pdb
EDJ-MED-40433386-8_1
sdf
pdb
−1.4
± 0.4
RUN4190
PET-UNK-29afea89-2_1
sdf
pdb
PET-UNK-acd70dee-3_1
sdf
pdb
−1.4
± 0.2
RUN2504
PET-UNK-29afea89-2_1
sdf
pdb
ALP-UNI-3496895b-2_4
sdf
pdb
−1.3
± 0.4
RUN2191
PET-UNK-29afea89-2_1
sdf
pdb
CHO-MSK-a31cca77-1_1
sdf
pdb
−1.3
± 0.4
RUN1907
PET-UNK-29afea89-2_1
sdf
pdb
JOH-UNI-ee5ed7c8-9_1
sdf
pdb
−1.3
± 0.5
RUN3276
PET-UNK-29afea89-2_1
sdf
pdb
LON-WEI-9739a092-10_1
sdf
pdb
−1.3
± 0.2
RUN1378
PET-UNK-29afea89-2_1
sdf
pdb
DAR-DIA-5ff57136-9_1
sdf
pdb
−1.3
± 0.5
RUN4895
PET-UNK-29afea89-2_1
sdf
pdb
ALF-EVA-07677224-1_2
sdf
pdb
−1.3
± 0.2
RUN2218
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-de59a476-2_2
sdf
pdb
−1.3
± 0.5
Last updated 2021-06-04T18:13:56.580002+00:00
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