COVID Moonshot Sprint 5
Summary
Compounds
Microstates
Transformations
(current)
Reliable transformations
Retrospective transformations
Transformations
Showing 2701 through 2800 of 5077
RUN
Initial microstate
Final microstate
ΔΔG / kcal M
-1
Work distribution
Convergence
RUN384
PET-UNK-29afea89-2_1
sdf
pdb
VLA-UCB-50c39ae8-1_1
sdf
pdb
0.5
± 0.3
RUN4862
PET-UNK-29afea89-2_1
sdf
pdb
ALP-POS-82da25a3-1_2
sdf
pdb
0.5
± 0.2
RUN915
PET-UNK-29afea89-2_1
sdf
pdb
MAK-UNK-c749d764-4_3
sdf
pdb
0.6
± 0.3
RUN3154
PET-UNK-29afea89-2_1
sdf
pdb
ROB-UNI-322e8f70-3_1
sdf
pdb
0.6
± 0.3
RUN3253
PET-UNK-29afea89-2_1
sdf
pdb
DAR-DIA-0f2f46c9-13_4
sdf
pdb
0.6
± 0.2
RUN2204
PET-UNK-29afea89-2_1
sdf
pdb
LEE-CAM-7ab9b158-1_6
sdf
pdb
0.6
± 0.4
RUN1898
PET-UNK-29afea89-2_1
sdf
pdb
PET-UNK-b87f07d0-1_1
sdf
pdb
0.6
± 0.5
RUN3912
PET-UNK-29afea89-2_1
sdf
pdb
EDJ-MED-009f762b-4_1
sdf
pdb
0.6
± 0.2
RUN1623
PET-UNK-29afea89-2_1
sdf
pdb
ED_-GRI-5b13fbe2-67_1
sdf
pdb
0.6
± 0.4
RUN1637
PET-UNK-29afea89-2_1
sdf
pdb
EDG-MED-4c68219f-1_2
sdf
pdb
0.6
± 0.5
RUN1667
PET-UNK-29afea89-2_1
sdf
pdb
EDG-MED-90036822-7_1
sdf
pdb
0.6
± 0.5
RUN40
PET-UNK-29afea89-2_1
sdf
pdb
ERI-UCB-ce40166b-5_1
sdf
pdb
0.6
± 0.4
RUN1812
PET-UNK-29afea89-2_1
sdf
pdb
EDG-MED-90036822-94_9
sdf
pdb
0.6
± 0.4
RUN1145
PET-UNK-29afea89-2_1
sdf
pdb
BEN-BAS-5c03e89e-1_2
sdf
pdb
0.6
± 0.3
RUN3367
PET-UNK-29afea89-2_1
sdf
pdb
DAR-DIA-0587064e-15_1
sdf
pdb
0.6
± 0.2
RUN3730
PET-UNK-29afea89-2_1
sdf
pdb
KAD-UNI-877d7bed-7_1
sdf
pdb
0.6
± 0.2
RUN3743
PET-UNK-29afea89-2_1
sdf
pdb
KAD-UNI-877d7bed-9_7
sdf
pdb
0.6
± 0.2
RUN4631
PET-UNK-29afea89-2_1
sdf
pdb
MIC-UNK-ea4eb352-1_2
sdf
pdb
0.6
± 0.2
RUN3131
PET-UNK-29afea89-2_1
sdf
pdb
ALP-POS-fe871b40-13_1
sdf
pdb
0.6
± 0.2
RUN3153
PET-UNK-29afea89-2_1
sdf
pdb
ROB-UNI-322e8f70-2_1
sdf
pdb
0.6
± 0.2
RUN2421
PET-UNK-29afea89-2_1
sdf
pdb
ALP-POS-5bb456a5-1_16
sdf
pdb
0.6
± 0.5
RUN4265
PET-UNK-29afea89-2_1
sdf
pdb
ALP-POS-347519b5-2_17
sdf
pdb
0.6
± 0.3
RUN339
PET-UNK-29afea89-2_1
sdf
pdb
DAR-DIA-6a508060-4_2
sdf
pdb
0.6
± 0.5
RUN4556
PET-UNK-29afea89-2_1
sdf
pdb
EDJ-MED-cf877e1d-2_1
sdf
pdb
0.6
± 0.2
RUN823
PET-UNK-29afea89-2_1
sdf
pdb
DAR-DIA-0d514e7d-20_1
sdf
pdb
0.6
± 0.3
RUN2295
PET-UNK-29afea89-2_1
sdf
pdb
KAD-UNI-80f122c8-3_7
sdf
pdb
0.6
± 0.3
RUN4954
PET-UNK-29afea89-2_1
sdf
pdb
EDJ-MED-e9a22d5d-2_1
sdf
pdb
0.6
± 0.3
RUN691
PET-UNK-29afea89-2_1
sdf
pdb
MAK-UNK-ffc90da7-2_8
sdf
pdb
0.6
± 0.1
RUN1693
PET-UNK-29afea89-2_1
sdf
pdb
EDG-MED-90036822-22_2
sdf
pdb
0.6
± 0.4
RUN983
PET-UNK-29afea89-2_1
sdf
pdb
MAK-UNK-c749d764-16_10
sdf
pdb
0.6
± 0.4
RUN4543
PET-UNK-29afea89-2_1
sdf
pdb
EDJ-MED-139368ae-3_4
sdf
pdb
0.6
± 0.3
RUN4587
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-61f37a1a-1_4
sdf
pdb
0.6
± 0.2
RUN3446
PET-UNK-29afea89-2_1
sdf
pdb
EDJ-MED-15e90dfc-5_2
sdf
pdb
0.6
± 0.2
RUN4279
PET-UNK-29afea89-2_1
sdf
pdb
ALP-POS-347519b5-2_32
sdf
pdb
0.6
± 0.4
RUN2855
PET-UNK-29afea89-2_1
sdf
pdb
ALF-EVA-650655fc-3_1
sdf
pdb
0.6
± 0.1
RUN3406
PET-UNK-29afea89-2_1
sdf
pdb
DAR-DIA-f6ee7aeb-2_4
sdf
pdb
0.6
± 0.2
RUN329
PET-UNK-29afea89-2_1
sdf
pdb
VLA-UCB-05e51b3f-17_1
sdf
pdb
0.6
± 0.7
RUN1323
PET-UNK-29afea89-2_1
sdf
pdb
LON-WEI-5e7d1b3e-16_1
sdf
pdb
0.6
± 0.3
RUN3994
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-4223bc15-6_2
sdf
pdb
0.6
± 0.2
RUN4655
PET-UNK-29afea89-2_1
sdf
pdb
MIC-UNK-ea4eb352-10_1
sdf
pdb
0.6
± 0.2
RUN4274
PET-UNK-29afea89-2_1
sdf
pdb
ALP-POS-347519b5-2_27
sdf
pdb
0.6
± 0.3
RUN3991
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-4223bc15-5_3
sdf
pdb
0.6
± 0.2
RUN4020
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-4223bc15-9_11
sdf
pdb
0.6
± 0.2
RUN566
PET-UNK-29afea89-2_1
sdf
pdb
MIC-UNK-cdc2493e-21_1
sdf
pdb
0.6
± 0.4
RUN442
PET-UNK-29afea89-2_1
sdf
pdb
RAL-THA-1d44ff04-8_1
sdf
pdb
0.6
± 0.4
RUN2834
PET-UNK-29afea89-2_1
sdf
pdb
EDJ-MED-ee07cf00-11_8
sdf
pdb
0.59
± 0.09
RUN4763
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-24589f88-1_1
sdf
pdb
0.6
± 0.3
RUN4005
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-4223bc15-8_5
sdf
pdb
0.6
± 0.2
RUN2157
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-fce787c2-9_2
sdf
pdb
0.6
± 0.3
RUN1945
PET-UNK-29afea89-2_1
sdf
pdb
JOH-UNI-50ce7ec3-3_1
sdf
pdb
0.6
± 0.4
RUN148
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-9ff17035-1_2
sdf
pdb
0.6
± 0.1
RUN116
PET-UNK-29afea89-2_1
sdf
pdb
PET-UNK-c9c1e0d8-2_1
sdf
pdb
0.6
± 0.3
RUN1840
PET-UNK-29afea89-2_1
sdf
pdb
EDG-MED-90036822-102_2
sdf
pdb
0.6
± 0.4
RUN3142
PET-UNK-29afea89-2_1
sdf
pdb
EDJ-MED-37aac4bd-2_2
sdf
pdb
0.6
± 0.2
RUN3982
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-4223bc15-3_2
sdf
pdb
0.6
± 0.4
RUN1868
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-281d2ee9-1_2
sdf
pdb
0.6
± 0.4
RUN1740
PET-UNK-29afea89-2_1
sdf
pdb
EDG-MED-90036822-57_2
sdf
pdb
0.6
± 0.5
RUN2875
PET-UNK-29afea89-2_1
sdf
pdb
ALF-EVA-650655fc-8_1
sdf
pdb
0.60
± 0.09
RUN4356
PET-UNK-29afea89-2_1
sdf
pdb
BEN-DND-d1eb1f41-4_1
sdf
pdb
0.6
± 0.2
RUN2303
PET-UNK-29afea89-2_1
sdf
pdb
VLA-UNK-56836b69-3_1
sdf
pdb
0.6
± 0.3
RUN1275
PET-UNK-29afea89-2_1
sdf
pdb
RAL-THA-8416115c-8_1
sdf
pdb
0.6
± 0.3
RUN4571
PET-UNK-29afea89-2_1
sdf
pdb
PET-UNK-bcc8fd08-2_1
sdf
pdb
0.6
± 0.2
RUN462
PET-UNK-29afea89-2_1
sdf
pdb
NIR-WEI-75ed5c39-1_1
sdf
pdb
0.6
± 0.4
RUN3881
PET-UNK-29afea89-2_1
sdf
pdb
EDJ-MED-670ad2ee-12_1
sdf
pdb
0.6
± 0.4
RUN4429
PET-UNK-29afea89-2_1
sdf
pdb
PET-UNK-9b23ef84-5_1
sdf
pdb
0.6
± 0.3
RUN3360
PET-UNK-29afea89-2_1
sdf
pdb
DAR-DIA-0587064e-12_1
sdf
pdb
0.61
± 0.10
RUN4779
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-24589f88-9_2
sdf
pdb
0.6
± 0.3
RUN726
PET-UNK-29afea89-2_1
sdf
pdb
MIC-UNK-5a93dd5f-1_5
sdf
pdb
0.6
± 0.3
RUN3585
PET-UNK-29afea89-2_1
sdf
pdb
ALP-POS-6d96567b-2_1
sdf
pdb
0.6
± 0.3
RUN4515
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-5f1400cf-2_2
sdf
pdb
0.6
± 0.4
RUN3620
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-5369c344-4_1
sdf
pdb
0.6
± 0.3
RUN1573
PET-UNK-29afea89-2_1
sdf
pdb
ED_-GRI-5b13fbe2-39_1
sdf
pdb
0.6
± 0.5
RUN979
PET-UNK-29afea89-2_1
sdf
pdb
MAK-UNK-c749d764-16_6
sdf
pdb
0.6
± 0.3
RUN1708
PET-UNK-29afea89-2_1
sdf
pdb
EDG-MED-90036822-35_2
sdf
pdb
0.6
± 0.5
RUN732
PET-UNK-29afea89-2_1
sdf
pdb
MAK-UNK-83e0a0b4-2_2
sdf
pdb
0.6
± 0.2
RUN1915
PET-UNK-29afea89-2_1
sdf
pdb
JOH-UNI-3fc3434e-6_1
sdf
pdb
0.6
± 0.5
RUN128
PET-UNK-29afea89-2_1
sdf
pdb
MIC-UNK-c66144cb-1_1
sdf
pdb
0.6
± 0.3
RUN3537
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-dd3ad2b5-4_1
sdf
pdb
0.6
± 0.2
RUN4076
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-4223bc15-16_3
sdf
pdb
0.6
± 0.3
RUN3914
PET-UNK-29afea89-2_1
sdf
pdb
EDJ-MED-009f762b-5_1
sdf
pdb
0.6
± 0.2
RUN3809
PET-UNK-29afea89-2_1
sdf
pdb
DAR-DIA-4987d2cd-3_1
sdf
pdb
0.6
± 0.2
RUN2847
PET-UNK-29afea89-2_1
sdf
pdb
EDJ-MED-8c98ee63-2_1
sdf
pdb
0.6
± 0.2
RUN2136
PET-UNK-29afea89-2_1
sdf
pdb
DAR-DIA-6be260fc-5_1
sdf
pdb
0.6
± 0.3
RUN1002
PET-UNK-29afea89-2_1
sdf
pdb
MAK-UNK-c749d764-19_5
sdf
pdb
0.6
± 0.2
RUN4765
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-24589f88-2_2
sdf
pdb
0.6
± 0.2
RUN2518
PET-UNK-29afea89-2_1
sdf
pdb
ALP-UNI-3496895b-5_7
sdf
pdb
0.6
± 0.3
RUN4566
PET-UNK-29afea89-2_1
sdf
pdb
ALP-POS-93b3621f-4_2
sdf
pdb
0.6
± 0.2
RUN749
PET-UNK-29afea89-2_1
sdf
pdb
MIC-UNK-5a93dd5f-3_10
sdf
pdb
0.6
± 0.3
RUN2316
PET-UNK-29afea89-2_1
sdf
pdb
VLA-UNK-f702bf1c-5_1
sdf
pdb
0.6
± 0.2
RUN2600
PET-UNK-29afea89-2_1
sdf
pdb
EDJ-MED-d203f206-38_1
sdf
pdb
0.6
± 0.3
RUN3110
PET-UNK-29afea89-2_1
sdf
pdb
ALP-POS-fe871b40-1_2
sdf
pdb
0.6
± 0.2
RUN2525
PET-UNK-29afea89-2_1
sdf
pdb
ALP-UNI-3496895b-13_1
sdf
pdb
0.6
± 0.3
RUN258
PET-UNK-29afea89-2_1
sdf
pdb
MIC-UNK-9582b2c5-1_6
sdf
pdb
0.6
± 0.3
RUN1986
PET-UNK-29afea89-2_1
sdf
pdb
RAL-THA-2d450e86-19_1
sdf
pdb
0.6
± 0.5
RUN199
PET-UNK-29afea89-2_1
sdf
pdb
LON-WEI-4d77710c-9_1
sdf
pdb
0.6
± 0.1
RUN5067
PET-UNK-29afea89-2_1
sdf
pdb
EDJ-MED-ce467fd5-1_1
sdf
pdb
0.6
± 0.2
RUN3138
PET-UNK-29afea89-2_1
sdf
pdb
ALP-POS-fe871b40-16_2
sdf
pdb
0.6
± 0.2
RUN4557
PET-UNK-29afea89-2_1
sdf
pdb
EDJ-MED-cf877e1d-2_2
sdf
pdb
0.6
± 0.2
RUN1571
PET-UNK-29afea89-2_1
sdf
pdb
ED_-GRI-5b13fbe2-36_2
sdf
pdb
0.6
± 0.3
RUN3719
PET-UNK-29afea89-2_1
sdf
pdb
KAD-UNI-877d7bed-1_1
sdf
pdb
0.6
± 0.2
Last updated 2021-06-04T18:13:56.580002+00:00
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