COVID Moonshot Sprint 5
Summary
Compounds
Microstates
Transformations
(current)
Reliable transformations
Retrospective transformations
Transformations
Showing 4601 through 4700 of 5077
RUN
Initial microstate
Final microstate
ΔΔG / kcal M
-1
Work distribution
Convergence
RUN2707
PET-UNK-29afea89-2_1
sdf
pdb
EDG-MED-ba1ac7b9-23_1
sdf
pdb
2.9
± 0.1
RUN4796
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-24589f88-14_3
sdf
pdb
2.9
± 0.2
RUN1790
PET-UNK-29afea89-2_1
sdf
pdb
EDG-MED-90036822-85_1
sdf
pdb
2.9
± 0.7
RUN4788
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-24589f88-11_3
sdf
pdb
2.9
± 0.3
RUN337
PET-UNK-29afea89-2_1
sdf
pdb
DAR-DIA-6a508060-3_2
sdf
pdb
2.9
± 0.3
RUN3987
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-4223bc15-4_4
sdf
pdb
2.9
± 0.2
RUN3670
PET-UNK-29afea89-2_1
sdf
pdb
BEN-DND-a02b439d-13_1
sdf
pdb
2.9
± 0.2
RUN4992
PET-UNK-29afea89-2_1
sdf
pdb
PET-UNK-1320d94d-21_1
sdf
pdb
2.9
± 0.3
RUN4853
PET-UNK-29afea89-2_1
sdf
pdb
MIC-UNK-54748b58-2_4
sdf
pdb
3.0
± 0.3
RUN3950
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-e6dd326d-7_1
sdf
pdb
3.0
± 0.6
RUN4560
PET-UNK-29afea89-2_1
sdf
pdb
ALP-POS-93b3621f-1_1
sdf
pdb
3.0
± 0.4
RUN4906
PET-UNK-29afea89-2_1
sdf
pdb
ALF-EVA-07677224-3_3
sdf
pdb
3.0
± 0.5
RUN4113
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-4223bc15-24_4
sdf
pdb
3.0
± 0.1
RUN2057
PET-UNK-29afea89-2_1
sdf
pdb
RAL-THA-05e671eb-26_1
sdf
pdb
3.0
± 0.3
RUN4844
PET-UNK-29afea89-2_1
sdf
pdb
ALF-EVA-82cf4849-11_2
sdf
pdb
3.0
± 0.3
RUN3339
PET-UNK-29afea89-2_1
sdf
pdb
MIC-UNK-d854bf4c-5_2
sdf
pdb
3.0
± 0.1
RUN2788
PET-UNK-29afea89-2_1
sdf
pdb
ALF-EVA-ced740bd-1_1
sdf
pdb
3.0
± 0.2
RUN4613
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-61f37a1a-10_2
sdf
pdb
3.0
± 0.3
RUN4648
PET-UNK-29afea89-2_1
sdf
pdb
MIC-UNK-ea4eb352-6_3
sdf
pdb
3.0
± 0.3
RUN1861
PET-UNK-29afea89-2_1
sdf
pdb
CHO-MSK-5891c1ff-5_1
sdf
pdb
3.0
± 0.5
RUN3336
PET-UNK-29afea89-2_1
sdf
pdb
MIC-UNK-d854bf4c-4_2
sdf
pdb
3.0
± 0.1
RUN1956
PET-UNK-29afea89-2_1
sdf
pdb
ALP-UNI-3735e77e-1_1
sdf
pdb
3.0
± 0.4
RUN2166
PET-UNK-29afea89-2_1
sdf
pdb
ALP-UNI-76695c4f-4_2
sdf
pdb
3.0
± 0.6
RUN4809
PET-UNK-29afea89-2_1
sdf
pdb
PET-UNK-2c6614b6-5_1
sdf
pdb
3.0
± 0.4
RUN179
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-bb423b95-9_1
sdf
pdb
3.0
± 0.2
RUN975
PET-UNK-29afea89-2_1
sdf
pdb
MAK-UNK-c749d764-16_2
sdf
pdb
3.0
± 0.2
RUN5124
PET-UNK-29afea89-2_1
sdf
pdb
MIC-UNK-37660950-4_4
sdf
pdb
3.0
± 0.2
RUN2784
PET-UNK-29afea89-2_1
sdf
pdb
ALP-UNI-dbbfd3db-15_1
sdf
pdb
3.0
± 0.3
RUN3803
PET-UNK-29afea89-2_1
sdf
pdb
DAR-DIA-4987d2cd-1_2
sdf
pdb
3.0
± 0.3
RUN4090
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-4223bc15-17_2
sdf
pdb
3.0
± 0.4
RUN4810
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-24589f88-16_4
sdf
pdb
3.0
± 0.3
RUN4747
PET-UNK-29afea89-2_1
sdf
pdb
PET-UNK-1e13ef09-1_1
sdf
pdb
3.0
± 0.3
RUN168
PET-UNK-29afea89-2_1
sdf
pdb
VLA-UCB-1dbca3b4-14_1
sdf
pdb
3.0
± 0.6
RUN1816
PET-UNK-29afea89-2_1
sdf
pdb
EDG-MED-90036822-94_13
sdf
pdb
3.0
± 0.3
RUN1329
PET-UNK-29afea89-2_1
sdf
pdb
LON-WEI-5e7d1b3e-20_1
sdf
pdb
3.0
± 0.4
RUN2949
PET-UNK-29afea89-2_1
sdf
pdb
ALP-UNI-8e43a71e-5_5
sdf
pdb
3.0
± 0.6
RUN801
PET-UNK-29afea89-2_1
sdf
pdb
MAK-UNK-3875bbc8-2_1
sdf
pdb
3.1
± 0.2
RUN3492
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-90505e2b-1_1
sdf
pdb
3.1
± 0.4
RUN4415
PET-UNK-29afea89-2_1
sdf
pdb
PET-UNK-03fd2068-9_1
sdf
pdb
3.1
± 0.3
RUN2732
PET-UNK-29afea89-2_1
sdf
pdb
EDG-MED-ba1ac7b9-28_1
sdf
pdb
3.1
± 0.3
RUN1589
PET-UNK-29afea89-2_1
sdf
pdb
ED_-GRI-5b13fbe2-50_3
sdf
pdb
3.1
± 0.4
RUN447
PET-UNK-29afea89-2_1
sdf
pdb
RAL-THA-1d44ff04-12_1
sdf
pdb
3.1
± 0.3
RUN2992
PET-UNK-29afea89-2_1
sdf
pdb
ALP-UNI-8e43a71e-15_9
sdf
pdb
3.1
± 0.3
RUN3469
PET-UNK-29afea89-2_1
sdf
pdb
RAL-THA-e002e396-11_1
sdf
pdb
3.1
± 0.3
RUN2616
PET-UNK-29afea89-2_1
sdf
pdb
EDG-MED-ba1ac7b9-1_1
sdf
pdb
3.1
± 0.3
RUN4745
PET-UNK-29afea89-2_1
sdf
pdb
PET-UNK-d61f3ea6-4_2
sdf
pdb
3.1
± 0.2
RUN4045
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-4223bc15-12_1
sdf
pdb
3.1
± 0.4
RUN5039
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-a3f7f96a-7_1
sdf
pdb
3.1
± 0.3
RUN4909
PET-UNK-29afea89-2_1
sdf
pdb
ALF-EVA-07677224-4_2
sdf
pdb
3.1
± 0.4
RUN4912
PET-UNK-29afea89-2_1
sdf
pdb
ALF-EVA-07677224-4_5
sdf
pdb
3.1
± 0.4
RUN4139
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-4223bc15-31_2
sdf
pdb
3.1
± 0.3
RUN978
PET-UNK-29afea89-2_1
sdf
pdb
MAK-UNK-c749d764-16_5
sdf
pdb
3.1
± 0.4
RUN1705
PET-UNK-29afea89-2_1
sdf
pdb
EDG-MED-90036822-33_2
sdf
pdb
3.1
± 0.5
RUN2201
PET-UNK-29afea89-2_1
sdf
pdb
LEE-CAM-7ab9b158-1_4
sdf
pdb
3.1
± 0.3
RUN2430
PET-UNK-29afea89-2_1
sdf
pdb
ALP-POS-5bb456a5-3_1
sdf
pdb
3.1
± 0.3
RUN1046
PET-UNK-29afea89-2_1
sdf
pdb
MAK-UNK-c749d764-25_7
sdf
pdb
3.1
± 0.4
RUN4707
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-dc2604c4-2_1
sdf
pdb
3.1
± 0.3
RUN4442
PET-UNK-29afea89-2_1
sdf
pdb
PET-UNK-9b23ef84-11_2
sdf
pdb
3.1
± 0.3
RUN1866
PET-UNK-29afea89-2_1
sdf
pdb
CHO-MSK-5891c1ff-8_1
sdf
pdb
3.1
± 0.6
RUN4817
PET-UNK-29afea89-2_1
sdf
pdb
PET-UNK-b78139fa-7_1
sdf
pdb
3.1
± 0.5
RUN1890
PET-UNK-29afea89-2_1
sdf
pdb
MIC-UNK-460e637d-3_2
sdf
pdb
3.1
± 0.4
RUN1029
PET-UNK-29afea89-2_1
sdf
pdb
MAK-UNK-c749d764-22_8
sdf
pdb
3.1
± 0.2
RUN1320
PET-UNK-29afea89-2_1
sdf
pdb
LON-WEI-5e7d1b3e-13_2
sdf
pdb
3.1
± 0.4
RUN4176
PET-UNK-29afea89-2_1
sdf
pdb
PET-UNK-1b92fa34-8_1
sdf
pdb
3.1
± 0.4
RUN2025
PET-UNK-29afea89-2_1
sdf
pdb
RAL-THA-05e671eb-12_2
sdf
pdb
3.1
± 0.5
RUN1811
PET-UNK-29afea89-2_1
sdf
pdb
EDG-MED-90036822-94_8
sdf
pdb
3.1
± 0.6
RUN2463
PET-UNK-29afea89-2_1
sdf
pdb
ALP-UNI-0676e700-17_1
sdf
pdb
3.1
± 0.3
RUN2521
PET-UNK-29afea89-2_1
sdf
pdb
ALP-UNI-3496895b-7_1
sdf
pdb
3.1
± 0.3
RUN729
PET-UNK-29afea89-2_1
sdf
pdb
MIC-UNK-5a93dd5f-1_6
sdf
pdb
3.1
± 0.2
RUN2957
PET-UNK-29afea89-2_1
sdf
pdb
ALP-UNI-8e43a71e-5_13
sdf
pdb
3.1
± 0.2
RUN4842
PET-UNK-29afea89-2_1
sdf
pdb
ALF-EVA-82cf4849-13_1
sdf
pdb
3.1
± 0.4
RUN2167
PET-UNK-29afea89-2_1
sdf
pdb
ALP-UNI-76695c4f-4_1
sdf
pdb
3.1
± 0.7
RUN1943
PET-UNK-29afea89-2_1
sdf
pdb
JOH-UNI-50ce7ec3-1_1
sdf
pdb
3.2
± 0.6
RUN3398
PET-UNK-29afea89-2_1
sdf
pdb
DAR-DIA-b4e9dd8d-5_1
sdf
pdb
3.2
± 0.1
RUN4944
PET-UNK-29afea89-2_1
sdf
pdb
ALF-EVA-07677224-10_1
sdf
pdb
3.2
± 0.3
RUN2889
PET-UNK-29afea89-2_1
sdf
pdb
DAR-DIA-ecdbc7dd-7_2
sdf
pdb
3.2
± 0.2
RUN4061
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-4223bc15-13_13
sdf
pdb
3.2
± 0.3
RUN4807
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-24589f88-15_4
sdf
pdb
3.2
± 0.4
RUN3008
PET-UNK-29afea89-2_1
sdf
pdb
ALP-UNI-8e43a71e-15_26
sdf
pdb
3.2
± 0.3
RUN3637
PET-UNK-29afea89-2_1
sdf
pdb
ALF-EVA-b701bd13-4_2
sdf
pdb
3.2
± 0.4
RUN4746
PET-UNK-29afea89-2_1
sdf
pdb
PET-UNK-d61f3ea6-4_4
sdf
pdb
3.2
± 0.4
RUN937
PET-UNK-29afea89-2_1
sdf
pdb
MAK-UNK-c749d764-8_6
sdf
pdb
3.2
± 0.3
RUN3459
PET-UNK-29afea89-2_1
sdf
pdb
RAL-THA-e002e396-4_1
sdf
pdb
3.2
± 0.2
RUN4214
PET-UNK-29afea89-2_1
sdf
pdb
EDJ-MED-923a35c2-2_1
sdf
pdb
3.2
± 0.3
RUN3568
PET-UNK-29afea89-2_1
sdf
pdb
ALP-POS-e4f7337d-1_4
sdf
pdb
3.2
± 0.2
RUN4286
PET-UNK-29afea89-2_1
sdf
pdb
ALP-POS-347519b5-2_39
sdf
pdb
3.2
± 0.1
RUN4876
PET-UNK-29afea89-2_1
sdf
pdb
ALP-POS-67d5babe-1_9
sdf
pdb
3.2
± 0.4
RUN4800
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-24589f88-13_1
sdf
pdb
3.2
± 0.5
RUN4381
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-64942dd0-1_1
sdf
pdb
3.2
± 0.3
RUN4996
PET-UNK-29afea89-2_1
sdf
pdb
PET-UNK-1320d94d-25_1
sdf
pdb
3.2
± 0.4
RUN4035
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-4223bc15-11_7
sdf
pdb
3.2
± 0.4
RUN1820
PET-UNK-29afea89-2_1
sdf
pdb
EDG-MED-90036822-94_16
sdf
pdb
3.2
± 0.5
RUN5028
PET-UNK-29afea89-2_1
sdf
pdb
VLA-MRT-a639d434-2_2
sdf
pdb
3.2
± 0.3
RUN4976
PET-UNK-29afea89-2_1
sdf
pdb
PET-UNK-1320d94d-7_1
sdf
pdb
3.2
± 0.5
RUN3549
PET-UNK-29afea89-2_1
sdf
pdb
EDJ-MED-cf4b0d25-4_1
sdf
pdb
3.2
± 0.2
RUN5078
PET-UNK-29afea89-2_1
sdf
pdb
BEN-DND-d6f8d3c6-1_1
sdf
pdb
3.2
± 0.3
RUN3381
PET-UNK-29afea89-2_1
sdf
pdb
DAR-DIA-0587064e-23_1
sdf
pdb
3.25
± 0.10
RUN4248
PET-UNK-29afea89-2_1
sdf
pdb
ALP-POS-347519b5-1_31
sdf
pdb
3.3
± 0.3
RUN2699
PET-UNK-29afea89-2_1
sdf
pdb
EDG-MED-ba1ac7b9-21_1
sdf
pdb
3.3
± 0.3
RUN4210
PET-UNK-29afea89-2_1
sdf
pdb
EDJ-MED-923a35c2-1_2
sdf
pdb
3.3
± 0.3
Last updated 2021-06-04T18:13:56.580002+00:00
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