COVID Moonshot Sprint 5
Summary
Compounds
Microstates
Transformations
(current)
Reliable transformations
Retrospective transformations
Transformations
Showing 1201 through 1300 of 5077
RUN
Initial microstate
Final microstate
ΔΔG / kcal M
-1
Work distribution
Convergence
RUN2238
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-e9e99895-2_2
sdf
pdb
−0.9
± 0.4
RUN3183
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-fb82b63d-4_4
sdf
pdb
−0.9
± 0.2
RUN3058
PET-UNK-29afea89-2_1
sdf
pdb
JAG-UCB-f37eaa14-2_1
sdf
pdb
−0.9
± 0.2
RUN4615
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-61f37a1a-13_2
sdf
pdb
−0.9
± 0.2
RUN2941
PET-UNK-29afea89-2_1
sdf
pdb
ALP-UNI-8e43a71e-4_1
sdf
pdb
−0.9
± 0.2
RUN1289
PET-UNK-29afea89-2_1
sdf
pdb
RAL-THA-8416115c-11_4
sdf
pdb
−0.9
± 0.5
RUN3453
PET-UNK-29afea89-2_1
sdf
pdb
RAL-THA-e002e396-2_1
sdf
pdb
−0.9
± 0.2
RUN1415
PET-UNK-29afea89-2_1
sdf
pdb
DAR-DIA-9e4459de-11_7
sdf
pdb
−0.9
± 0.2
RUN735
PET-UNK-29afea89-2_1
sdf
pdb
MIC-UNK-5a93dd5f-2_2
sdf
pdb
−0.9
± 0.4
RUN1246
PET-UNK-29afea89-2_1
sdf
pdb
RAL-THA-4aa06b95-7_4
sdf
pdb
−0.9
± 0.3
RUN3291
PET-UNK-29afea89-2_1
sdf
pdb
PET-UNK-824b5c6a-3_1
sdf
pdb
−0.9
± 0.2
RUN1728
PET-UNK-29afea89-2_1
sdf
pdb
EDG-MED-90036822-50_1
sdf
pdb
−0.9
± 0.3
RUN24
PET-UNK-29afea89-2_1
sdf
pdb
DAR-DIA-0cde14eb-56_2
sdf
pdb
−0.9
± 0.1
RUN1553
PET-UNK-29afea89-2_1
sdf
pdb
ED_-GRI-5b13fbe2-19_1
sdf
pdb
−0.9
± 0.1
RUN3405
PET-UNK-29afea89-2_1
sdf
pdb
DAR-DIA-f6ee7aeb-2_2
sdf
pdb
−0.9
± 0.2
RUN3284
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-78e1d523-3_1
sdf
pdb
−0.9
± 0.2
RUN1477
PET-UNK-29afea89-2_1
sdf
pdb
BEN-DND-a7517465-1_1
sdf
pdb
−0.9
± 0.3
RUN715
PET-UNK-29afea89-2_1
sdf
pdb
MAK-UNK-ffc90da7-9_4
sdf
pdb
−0.9
± 0.3
RUN1846
PET-UNK-29afea89-2_1
sdf
pdb
EDG-MED-90036822-108_1
sdf
pdb
−0.9
± 0.3
RUN416
PET-UNK-29afea89-2_1
sdf
pdb
DAR-DIA-23e5a6a0-8_2
sdf
pdb
−0.9
± 0.4
RUN2860
PET-UNK-29afea89-2_1
sdf
pdb
ALF-EVA-650655fc-4_4
sdf
pdb
−0.9
± 0.1
RUN265
PET-UNK-29afea89-2_1
sdf
pdb
MIC-UNK-9582b2c5-2_4
sdf
pdb
−0.9
± 0.4
RUN3160
PET-UNK-29afea89-2_1
sdf
pdb
EDJ-MED-4f704dc9-1_2
sdf
pdb
−0.9
± 0.1
RUN2909
PET-UNK-29afea89-2_1
sdf
pdb
DAR-DIA-ecdbc7dd-19_1
sdf
pdb
−0.9
± 0.1
RUN2435
PET-UNK-29afea89-2_1
sdf
pdb
ALP-POS-5bb456a5-7_1
sdf
pdb
−0.9
± 0.4
RUN1079
PET-UNK-29afea89-2_1
sdf
pdb
MAK-UNK-c749d764-33_1
sdf
pdb
−0.9
± 0.3
RUN2229
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-2905de8c-2_1
sdf
pdb
−0.9
± 0.4
RUN2571
PET-UNK-29afea89-2_1
sdf
pdb
EDJ-MED-d203f206-8_1
sdf
pdb
−0.9
± 0.4
RUN1081
PET-UNK-29afea89-2_1
sdf
pdb
MAK-UNK-c749d764-33_3
sdf
pdb
−0.9
± 0.4
RUN3716
PET-UNK-29afea89-2_1
sdf
pdb
KAD-UNI-cb0f2bbc-24_1
sdf
pdb
−0.9
± 0.1
RUN1234
PET-UNK-29afea89-2_1
sdf
pdb
RAL-THA-4aa06b95-3_2
sdf
pdb
−0.9
± 0.3
RUN806
PET-UNK-29afea89-2_1
sdf
pdb
DAR-DIA-0d514e7d-2_1
sdf
pdb
−0.9
± 0.3
RUN1025
PET-UNK-29afea89-2_1
sdf
pdb
MAK-UNK-c749d764-22_4
sdf
pdb
−0.9
± 0.5
RUN3911
PET-UNK-29afea89-2_1
sdf
pdb
EDJ-MED-009f762b-2_2
sdf
pdb
−0.9
± 0.1
RUN1440
PET-UNK-29afea89-2_1
sdf
pdb
DAR-DIA-9e4459de-13_16
sdf
pdb
−0.9
± 0.4
RUN2642
PET-UNK-29afea89-2_1
sdf
pdb
EDG-MED-ba1ac7b9-7_3
sdf
pdb
−0.9
± 0.4
RUN1899
PET-UNK-29afea89-2_1
sdf
pdb
PET-UNK-b87f07d0-2_1
sdf
pdb
−0.9
± 0.4
RUN2793
PET-UNK-29afea89-2_1
sdf
pdb
ALF-EVA-ced740bd-3_2
sdf
pdb
−0.9
± 0.1
RUN4979
PET-UNK-29afea89-2_1
sdf
pdb
PET-UNK-1320d94d-8_1
sdf
pdb
−0.9
± 0.2
RUN1322
PET-UNK-29afea89-2_1
sdf
pdb
LON-WEI-5e7d1b3e-18_1
sdf
pdb
−0.9
± 0.3
RUN3301
PET-UNK-29afea89-2_1
sdf
pdb
VLA-UNK-ba665ac8-2_1
sdf
pdb
−0.9
± 0.2
RUN1525
PET-UNK-29afea89-2_1
sdf
pdb
ED_-GRI-5b13fbe2-4_1
sdf
pdb
−0.9
± 0.3
RUN2917
PET-UNK-29afea89-2_1
sdf
pdb
VLA-UNK-5c5a631c-1_3
sdf
pdb
−0.9
± 0.1
RUN1294
PET-UNK-29afea89-2_1
sdf
pdb
RAL-THA-8416115c-12_4
sdf
pdb
−0.9
± 0.3
RUN3280
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-78e1d523-2_1
sdf
pdb
−0.9
± 0.2
RUN2114
PET-UNK-29afea89-2_1
sdf
pdb
KAD-UNI-8a629cb0-30_1
sdf
pdb
−0.9
± 0.4
RUN3065
PET-UNK-29afea89-2_1
sdf
pdb
JAG-UCB-f37eaa14-5_2
sdf
pdb
−0.9
± 0.2
RUN1016
PET-UNK-29afea89-2_1
sdf
pdb
MAK-UNK-c749d764-21_3
sdf
pdb
−0.9
± 0.2
RUN1352
PET-UNK-29afea89-2_1
sdf
pdb
LON-WEI-5e7d1b3e-40_1
sdf
pdb
−0.9
± 0.2
RUN4293
PET-UNK-29afea89-2_1
sdf
pdb
ALP-POS-347519b5-2_46
sdf
pdb
−0.9
± 0.3
RUN3760
PET-UNK-29afea89-2_1
sdf
pdb
KAD-UNI-877d7bed-14_1
sdf
pdb
−0.8
± 0.2
RUN1453
PET-UNK-29afea89-2_1
sdf
pdb
DAR-DIA-9e4459de-15_15
sdf
pdb
−0.8
± 0.5
RUN3290
PET-UNK-29afea89-2_1
sdf
pdb
PET-UNK-7a31b064-2_1
sdf
pdb
−0.8
± 0.2
RUN1953
PET-UNK-29afea89-2_1
sdf
pdb
ALP-POS-869ac754-2_2
sdf
pdb
−0.8
± 0.6
RUN607
PET-UNK-29afea89-2_1
sdf
pdb
ADA-UCB-dc2b944c-9_1
sdf
pdb
−0.8
± 0.3
RUN1394
PET-UNK-29afea89-2_1
sdf
pdb
NAU-LAT-4ce8bf23-1_2
sdf
pdb
−0.8
± 0.4
RUN362
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-8a69d52e-1_3
sdf
pdb
−0.8
± 0.2
RUN2234
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-e9e99895-1_2
sdf
pdb
−0.8
± 0.4
RUN1155
PET-UNK-29afea89-2_1
sdf
pdb
MAK-UNK-b7886382-1_1
sdf
pdb
−0.8
± 0.3
RUN1216
PET-UNK-29afea89-2_1
sdf
pdb
BEN-DND-c852c98b-6_2
sdf
pdb
−0.8
± 0.3
RUN349
PET-UNK-29afea89-2_1
sdf
pdb
DAR-DIA-6a508060-10_1
sdf
pdb
−0.8
± 0.4
RUN2397
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-f9802937-4_1
sdf
pdb
−0.8
± 0.3
RUN3219
PET-UNK-29afea89-2_1
sdf
pdb
DAR-DIA-0f2f46c9-1_2
sdf
pdb
−0.8
± 0.2
RUN547
PET-UNK-29afea89-2_1
sdf
pdb
MIC-UNK-cdc2493e-10_3
sdf
pdb
−0.8
± 0.3
RUN3674
PET-UNK-29afea89-2_1
sdf
pdb
BEN-DND-34fc7f90-8_1
sdf
pdb
−0.8
± 0.1
RUN2649
PET-UNK-29afea89-2_1
sdf
pdb
EDG-MED-ba1ac7b9-9_4
sdf
pdb
−0.8
± 0.5
RUN3887
PET-UNK-29afea89-2_1
sdf
pdb
VLA-UNK-5b0345c3-3_2
sdf
pdb
−0.8
± 0.5
RUN191
PET-UNK-29afea89-2_1
sdf
pdb
MIC-UNK-6ab519a7-1_1
sdf
pdb
−0.8
± 0.4
RUN3521
PET-UNK-29afea89-2_1
sdf
pdb
MIC-UNK-0a05c952-4_1
sdf
pdb
−0.8
± 0.2
RUN1539
PET-UNK-29afea89-2_1
sdf
pdb
ED_-GRI-5b13fbe2-12_2
sdf
pdb
−0.8
± 0.2
RUN61
PET-UNK-29afea89-2_1
sdf
pdb
ALP-POS-3b848b35-4_1
sdf
pdb
−0.8
± 0.3
RUN511
PET-UNK-29afea89-2_1
sdf
pdb
MAK-UNK-8be7dca9-10_1
sdf
pdb
−0.8
± 0.3
RUN2413
PET-UNK-29afea89-2_1
sdf
pdb
ALP-POS-5bb456a5-1_8
sdf
pdb
−0.8
± 0.3
RUN2161
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-fce787c2-10_2
sdf
pdb
−0.8
± 0.3
RUN655
PET-UNK-29afea89-2_1
sdf
pdb
EDJ-MED-28ec730d-5_1
sdf
pdb
−0.8
± 0.4
RUN1442
PET-UNK-29afea89-2_1
sdf
pdb
DAR-DIA-9e4459de-15_3
sdf
pdb
−0.8
± 0.2
RUN4594
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-61f37a1a-4_2
sdf
pdb
−0.8
± 0.3
RUN1523
PET-UNK-29afea89-2_1
sdf
pdb
ED_-GRI-5b13fbe2-3_1
sdf
pdb
−0.8
± 0.2
RUN4692
PET-UNK-29afea89-2_1
sdf
pdb
EDJ-MED-1981ceba-3_4
sdf
pdb
−0.8
± 0.2
RUN3171
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-fb82b63d-2_1
sdf
pdb
−0.8
± 0.2
RUN2368
PET-UNK-29afea89-2_1
sdf
pdb
EDG-MED-5d232de5-5_2
sdf
pdb
−0.8
± 0.2
RUN4191
PET-UNK-29afea89-2_1
sdf
pdb
PET-UNK-acd70dee-5_1
sdf
pdb
−0.82
± 0.08
RUN2506
PET-UNK-29afea89-2_1
sdf
pdb
ALP-UNI-3496895b-2_5
sdf
pdb
−0.8
± 0.3
RUN4675
PET-UNK-29afea89-2_1
sdf
pdb
EDJ-MED-fa7708b3-2_3
sdf
pdb
−0.8
± 0.2
RUN1196
PET-UNK-29afea89-2_1
sdf
pdb
BEN-DND-f2e727cd-5_1
sdf
pdb
−0.8
± 0.2
RUN3255
PET-UNK-29afea89-2_1
sdf
pdb
MIC-UNK-b9827f26-4_1
sdf
pdb
−0.8
± 0.1
RUN3173
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-fb82b63d-3_1
sdf
pdb
−0.8
± 0.1
RUN3068
PET-UNK-29afea89-2_1
sdf
pdb
JAG-UCB-f37eaa14-8_1
sdf
pdb
−0.8
± 0.2
RUN4328
PET-UNK-29afea89-2_1
sdf
pdb
ALP-UNI-dbb9503d-1_1
sdf
pdb
−0.8
± 0.2
RUN3073
PET-UNK-29afea89-2_1
sdf
pdb
ALP-UNI-ba800595-1_2
sdf
pdb
−0.8
± 0.1
RUN3159
PET-UNK-29afea89-2_1
sdf
pdb
EDJ-MED-4f704dc9-1_1
sdf
pdb
−0.8
± 0.2
RUN3699
PET-UNK-29afea89-2_1
sdf
pdb
KAD-UNI-cb0f2bbc-10_2
sdf
pdb
−0.8
± 0.1
RUN1722
PET-UNK-29afea89-2_1
sdf
pdb
EDG-MED-90036822-39_2
sdf
pdb
−0.8
± 0.3
RUN1558
PET-UNK-29afea89-2_1
sdf
pdb
ED_-GRI-5b13fbe2-30_1
sdf
pdb
−0.8
± 0.4
RUN1285
PET-UNK-29afea89-2_1
sdf
pdb
RAL-THA-8416115c-10_3
sdf
pdb
−0.8
± 0.2
RUN3638
PET-UNK-29afea89-2_1
sdf
pdb
ALF-EVA-b701bd13-5_1
sdf
pdb
−0.8
± 0.4
RUN2124
PET-UNK-29afea89-2_1
sdf
pdb
KAD-UNI-8a629cb0-38_2
sdf
pdb
−0.8
± 0.4
RUN592
PET-UNK-29afea89-2_1
sdf
pdb
MIC-UNK-bcd487e9-6_1
sdf
pdb
−0.8
± 0.4
RUN1053
PET-UNK-29afea89-2_1
sdf
pdb
MAK-UNK-c749d764-26_8
sdf
pdb
−0.8
± 0.4
RUN3522
PET-UNK-29afea89-2_1
sdf
pdb
MIC-UNK-0a05c952-4_2
sdf
pdb
−0.8
± 0.2
Last updated 2021-06-04T18:13:56.580002+00:00
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