COVID Moonshot Sprint 5
Summary
Compounds
Microstates
Transformations
(current)
Reliable transformations
Retrospective transformations
Transformations
Showing 3801 through 3900 of 5077
RUN
Initial microstate
Final microstate
ΔΔG / kcal M
-1
Work distribution
Convergence
RUN3974
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-4223bc15-1_2
sdf
pdb
1.6
± 0.2
RUN3919
PET-UNK-29afea89-2_1
sdf
pdb
PET-UNK-49566573-1_1
sdf
pdb
1.6
± 0.3
RUN2089
PET-UNK-29afea89-2_1
sdf
pdb
KAD-UNI-8a629cb0-4_1
sdf
pdb
1.6
± 0.7
RUN1930
PET-UNK-29afea89-2_1
sdf
pdb
EDJ-MED-4c7486ba-7_1
sdf
pdb
1.6
± 0.4
RUN71
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-b5746674-42_1
sdf
pdb
1.6
± 0.2
RUN4437
PET-UNK-29afea89-2_1
sdf
pdb
PET-UNK-9b23ef84-9_1
sdf
pdb
1.6
± 0.3
RUN5032
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-a3f7f96a-1_1
sdf
pdb
1.6
± 0.3
RUN2589
PET-UNK-29afea89-2_1
sdf
pdb
EDJ-MED-d203f206-29_1
sdf
pdb
1.6
± 0.3
RUN2904
PET-UNK-29afea89-2_1
sdf
pdb
DAR-DIA-ecdbc7dd-13_2
sdf
pdb
1.6
± 0.1
RUN4622
PET-UNK-29afea89-2_1
sdf
pdb
ALP-POS-a577c8a2-2_1
sdf
pdb
1.6
± 0.3
RUN3853
PET-UNK-29afea89-2_1
sdf
pdb
VLA-UNK-8e76d113-1_1
sdf
pdb
1.6
± 0.1
RUN2940
PET-UNK-29afea89-2_1
sdf
pdb
ALP-UNI-8e43a71e-3_2
sdf
pdb
1.6
± 0.7
RUN3850
PET-UNK-29afea89-2_1
sdf
pdb
PET-UNK-5d7c542f-2_1
sdf
pdb
1.6
± 0.4
RUN3922
PET-UNK-29afea89-2_1
sdf
pdb
PET-UNK-49566573-3_1
sdf
pdb
1.6
± 0.2
RUN4816
PET-UNK-29afea89-2_1
sdf
pdb
PET-UNK-b78139fa-5_1
sdf
pdb
1.6
± 0.4
RUN2028
PET-UNK-29afea89-2_1
sdf
pdb
RAL-THA-05e671eb-11_1
sdf
pdb
1.6
± 0.6
RUN4545
PET-UNK-29afea89-2_1
sdf
pdb
EDJ-MED-139368ae-4_2
sdf
pdb
1.6
± 0.2
RUN4933
PET-UNK-29afea89-2_1
sdf
pdb
ALF-EVA-07677224-7_2
sdf
pdb
1.6
± 0.3
RUN1889
PET-UNK-29afea89-2_1
sdf
pdb
MIC-UNK-460e637d-3_1
sdf
pdb
1.6
± 0.4
RUN4205
PET-UNK-29afea89-2_1
sdf
pdb
MIC-UNK-6e9f8a43-1_2
sdf
pdb
1.6
± 0.4
RUN4318
PET-UNK-29afea89-2_1
sdf
pdb
ALP-POS-347519b5-3_41
sdf
pdb
1.6
± 0.1
RUN4815
PET-UNK-29afea89-2_1
sdf
pdb
PET-UNK-4b4f2bb7-7_1
sdf
pdb
1.6
± 0.2
RUN4298
PET-UNK-29afea89-2_1
sdf
pdb
ALP-POS-347519b5-3_11
sdf
pdb
1.6
± 0.4
RUN3857
PET-UNK-29afea89-2_1
sdf
pdb
PET-UNK-5d7c542f-3_1
sdf
pdb
1.6
± 0.3
RUN4314
PET-UNK-29afea89-2_1
sdf
pdb
ALP-POS-347519b5-3_39
sdf
pdb
1.6
± 0.3
RUN4595
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-61f37a1a-7_1
sdf
pdb
1.6
± 0.4
RUN3059
PET-UNK-29afea89-2_1
sdf
pdb
ERI-UCB-b3e6b0c2-17_2
sdf
pdb
1.6
± 0.3
RUN5107
PET-UNK-29afea89-2_1
sdf
pdb
EDJ-MED-827e7cb4-6_2
sdf
pdb
1.6
± 0.2
RUN3371
PET-UNK-29afea89-2_1
sdf
pdb
DAR-DIA-0587064e-18_2
sdf
pdb
1.6
± 0.2
RUN3509
PET-UNK-29afea89-2_1
sdf
pdb
MIC-UNK-0a05c952-2_5
sdf
pdb
1.6
± 0.1
RUN3506
PET-UNK-29afea89-2_1
sdf
pdb
MIC-UNK-0a05c952-2_2
sdf
pdb
1.6
± 0.3
RUN4449
PET-UNK-29afea89-2_1
sdf
pdb
PET-UNK-9b23ef84-15_1
sdf
pdb
1.6
± 0.2
RUN2030
PET-UNK-29afea89-2_1
sdf
pdb
RAL-THA-05e671eb-13_1
sdf
pdb
1.6
± 0.6
RUN2976
PET-UNK-29afea89-2_1
sdf
pdb
ALP-UNI-8e43a71e-10_1
sdf
pdb
1.6
± 0.2
RUN1788
PET-UNK-29afea89-2_1
sdf
pdb
EDG-MED-90036822-84_1
sdf
pdb
1.6
± 0.7
RUN3370
PET-UNK-29afea89-2_1
sdf
pdb
DAR-DIA-0587064e-17_2
sdf
pdb
1.65
± 0.08
RUN4116
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-4223bc15-25_4
sdf
pdb
1.6
± 0.1
RUN4491
PET-UNK-29afea89-2_1
sdf
pdb
RAL-THA-b9d6aec1-2_2
sdf
pdb
1.7
± 0.2
RUN4024
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-4223bc15-9_15
sdf
pdb
1.7
± 0.5
RUN2776
PET-UNK-29afea89-2_1
sdf
pdb
ALP-UNI-dbbfd3db-9_1
sdf
pdb
1.7
± 0.3
RUN2910
PET-UNK-29afea89-2_1
sdf
pdb
DAR-DIA-ecdbc7dd-19_2
sdf
pdb
1.7
± 0.2
RUN4334
PET-UNK-29afea89-2_1
sdf
pdb
EDJ-MED-7587a9ee-2_1
sdf
pdb
1.7
± 0.3
RUN3012
PET-UNK-29afea89-2_1
sdf
pdb
DAR-DIA-0f7b7cd9-7_1
sdf
pdb
1.7
± 0.3
RUN4729
PET-UNK-29afea89-2_1
sdf
pdb
EDJ-MED-c82a5324-2_3
sdf
pdb
1.7
± 0.3
RUN2056
PET-UNK-29afea89-2_1
sdf
pdb
RAL-THA-05e671eb-26_2
sdf
pdb
1.7
± 0.5
RUN2617
PET-UNK-29afea89-2_1
sdf
pdb
EDG-MED-ba1ac7b9-1_2
sdf
pdb
1.7
± 0.3
RUN5040
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-a3f7f96a-6_2
sdf
pdb
1.7
± 0.2
RUN4097
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-4223bc15-21_1
sdf
pdb
1.7
± 0.3
RUN2604
PET-UNK-29afea89-2_1
sdf
pdb
EDJ-MED-d203f206-43_1
sdf
pdb
1.7
± 0.3
RUN2012
PET-UNK-29afea89-2_1
sdf
pdb
RAL-THA-05e671eb-4_2
sdf
pdb
1.7
± 0.4
RUN2569
PET-UNK-29afea89-2_1
sdf
pdb
EDJ-MED-d203f206-5_1
sdf
pdb
1.7
± 0.4
RUN4536
PET-UNK-29afea89-2_1
sdf
pdb
EDJ-MED-139368ae-2_1
sdf
pdb
1.7
± 0.3
RUN3807
PET-UNK-29afea89-2_1
sdf
pdb
DAR-DIA-4987d2cd-2_3
sdf
pdb
1.7
± 0.3
RUN3041
PET-UNK-29afea89-2_1
sdf
pdb
ERI-UCB-b3e6b0c2-8_1
sdf
pdb
1.66
± 0.09
RUN5063
PET-UNK-29afea89-2_1
sdf
pdb
MIC-UNK-06e5f114-3_2
sdf
pdb
1.7
± 0.4
RUN4813
PET-UNK-29afea89-2_1
sdf
pdb
PET-UNK-4b4f2bb7-6_1
sdf
pdb
1.7
± 0.2
RUN3410
PET-UNK-29afea89-2_1
sdf
pdb
DAR-DIA-f6ee7aeb-3_4
sdf
pdb
1.7
± 0.3
RUN2985
PET-UNK-29afea89-2_1
sdf
pdb
ALP-UNI-8e43a71e-15_3
sdf
pdb
1.7
± 0.3
RUN1017
PET-UNK-29afea89-2_1
sdf
pdb
MAK-UNK-c749d764-21_4
sdf
pdb
1.7
± 0.2
RUN4134
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-4223bc15-30_2
sdf
pdb
1.7
± 0.3
RUN2484
PET-UNK-29afea89-2_1
sdf
pdb
JOH-UNI-ea72002d-3_1
sdf
pdb
1.7
± 0.3
RUN4473
PET-UNK-29afea89-2_1
sdf
pdb
EDJ-MED-1b5395f9-6_1
sdf
pdb
1.7
± 0.3
RUN4880
PET-UNK-29afea89-2_1
sdf
pdb
ALP-POS-67d5babe-1_15
sdf
pdb
1.7
± 0.4
RUN3072
PET-UNK-29afea89-2_1
sdf
pdb
ALP-UNI-ba800595-1_1
sdf
pdb
1.7
± 0.3
RUN2330
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-e69ad64a-2_1
sdf
pdb
1.7
± 0.3
RUN4064
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-4223bc15-13_16
sdf
pdb
1.7
± 0.5
RUN1656
PET-UNK-29afea89-2_1
sdf
pdb
EDG-MED-90036822-2_1
sdf
pdb
1.7
± 0.3
RUN4135
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-4223bc15-30_3
sdf
pdb
1.7
± 0.3
RUN5114
PET-UNK-29afea89-2_1
sdf
pdb
MIC-UNK-37660950-3_3
sdf
pdb
1.7
± 0.4
RUN4540
PET-UNK-29afea89-2_1
sdf
pdb
EDJ-MED-139368ae-3_1
sdf
pdb
1.7
± 0.3
RUN5054
PET-UNK-29afea89-2_1
sdf
pdb
ALP-POS-f1807566-2_1
sdf
pdb
1.7
± 0.4
RUN1149
PET-UNK-29afea89-2_1
sdf
pdb
BEN-BAS-5c03e89e-1_3
sdf
pdb
1.7
± 0.4
RUN3869
PET-UNK-29afea89-2_1
sdf
pdb
EDJ-MED-670ad2ee-6_1
sdf
pdb
1.7
± 0.6
RUN4769
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-24589f88-5_2
sdf
pdb
1.7
± 0.2
RUN1225
PET-UNK-29afea89-2_1
sdf
pdb
ALP-POS-966f8da6-2_1
sdf
pdb
1.7
± 0.3
RUN1987
PET-UNK-29afea89-2_1
sdf
pdb
RAL-THA-2d450e86-23_1
sdf
pdb
1.7
± 0.4
RUN4306
PET-UNK-29afea89-2_1
sdf
pdb
ALP-POS-347519b5-3_25
sdf
pdb
1.7
± 0.3
RUN1181
PET-UNK-29afea89-2_1
sdf
pdb
ALP-POS-c3a96089-1_1
sdf
pdb
1.7
± 0.4
RUN1750
PET-UNK-29afea89-2_1
sdf
pdb
EDG-MED-90036822-68_1
sdf
pdb
1.7
± 0.4
RUN810
PET-UNK-29afea89-2_1
sdf
pdb
DAR-DIA-0d514e7d-7_1
sdf
pdb
1.7
± 0.3
RUN3785
PET-UNK-29afea89-2_1
sdf
pdb
KAD-UNI-b13decd3-5_1
sdf
pdb
1.7
± 0.3
RUN4774
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-24589f88-4_3
sdf
pdb
1.7
± 0.3
RUN4682
PET-UNK-29afea89-2_1
sdf
pdb
EDJ-MED-1981ceba-1_2
sdf
pdb
1.7
± 0.4
RUN2485
PET-UNK-29afea89-2_1
sdf
pdb
JOH-UNI-ea72002d-3_2
sdf
pdb
1.7
± 0.3
RUN3317
PET-UNK-29afea89-2_1
sdf
pdb
EDJ-MED-946e547c-1_2
sdf
pdb
1.7
± 0.2
RUN3978
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-4223bc15-2_2
sdf
pdb
1.7
± 0.3
RUN4141
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-4223bc15-32_1
sdf
pdb
1.7
± 0.3
RUN5019
PET-UNK-29afea89-2_1
sdf
pdb
VLA-MRT-8c78ee15-2_1
sdf
pdb
1.7
± 0.4
RUN2170
PET-UNK-29afea89-2_1
sdf
pdb
ALP-UNI-76695c4f-4_4
sdf
pdb
1.7
± 0.3
RUN1556
PET-UNK-29afea89-2_1
sdf
pdb
ED_-GRI-5b13fbe2-26_1
sdf
pdb
1.7
± 0.5
RUN2994
PET-UNK-29afea89-2_1
sdf
pdb
ALP-UNI-8e43a71e-15_12
sdf
pdb
1.7
± 0.3
RUN2646
PET-UNK-29afea89-2_1
sdf
pdb
EDG-MED-ba1ac7b9-9_1
sdf
pdb
1.7
± 0.3
RUN796
PET-UNK-29afea89-2_1
sdf
pdb
MAK-UNK-3875bbc8-1_1
sdf
pdb
1.7
± 0.1
RUN4706
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-dc2604c4-1_4
sdf
pdb
1.7
± 0.2
RUN2196
PET-UNK-29afea89-2_1
sdf
pdb
CHO-MSK-a31cca77-3_2
sdf
pdb
1.7
± 0.4
RUN1136
PET-UNK-29afea89-2_1
sdf
pdb
BEN-BAS-c2bc0d80-2_2
sdf
pdb
1.7
± 0.5
RUN2457
PET-UNK-29afea89-2_1
sdf
pdb
ALP-UNI-0676e700-13_1
sdf
pdb
1.7
± 0.3
RUN3467
PET-UNK-29afea89-2_1
sdf
pdb
RAL-THA-e002e396-8_1
sdf
pdb
1.7
± 0.1
RUN5109
PET-UNK-29afea89-2_1
sdf
pdb
EDJ-MED-827e7cb4-9_2
sdf
pdb
1.7
± 0.2
RUN2740
PET-UNK-29afea89-2_1
sdf
pdb
EDG-MED-ba1ac7b9-31_2
sdf
pdb
1.74
± 0.08
Last updated 2021-06-04T18:13:56.580002+00:00
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