COVID Moonshot Sprint 5
Summary
Compounds
Microstates
Transformations
(current)
Reliable transformations
Retrospective transformations
Transformations
Showing 4401 through 4500 of 5077
RUN
Initial microstate
Final microstate
ΔΔG / kcal M
-1
Work distribution
Convergence
RUN1972
PET-UNK-29afea89-2_1
sdf
pdb
RAL-THA-2d450e86-6_1
sdf
pdb
2.5
± 0.5
RUN3971
PET-UNK-29afea89-2_1
sdf
pdb
PET-UNK-9bf1291a-4_2
sdf
pdb
2.5
± 0.3
RUN2013
PET-UNK-29afea89-2_1
sdf
pdb
RAL-THA-05e671eb-4_1
sdf
pdb
2.5
± 0.5
RUN3604
PET-UNK-29afea89-2_1
sdf
pdb
JIN-POS-6dc588a4-24_1
sdf
pdb
2.5
± 0.3
RUN1774
PET-UNK-29afea89-2_1
sdf
pdb
EDG-MED-90036822-80_1
sdf
pdb
2.5
± 0.5
RUN4501
PET-UNK-29afea89-2_1
sdf
pdb
EDG-MED-10fcb19e-2_2
sdf
pdb
2.5
± 0.4
RUN2287
PET-UNK-29afea89-2_1
sdf
pdb
KAD-UNI-80f122c8-3_2
sdf
pdb
2.5
± 0.5
RUN4832
PET-UNK-29afea89-2_1
sdf
pdb
ALF-EVA-82cf4849-4_1
sdf
pdb
2.5
± 0.2
RUN3375
PET-UNK-29afea89-2_1
sdf
pdb
DAR-DIA-0587064e-19_2
sdf
pdb
2.5
± 0.1
RUN2200
PET-UNK-29afea89-2_1
sdf
pdb
LEE-CAM-7ab9b158-1_2
sdf
pdb
2.5
± 0.4
RUN4634
PET-UNK-29afea89-2_1
sdf
pdb
MIC-UNK-ea4eb352-2_1
sdf
pdb
2.5
± 0.3
RUN1602
PET-UNK-29afea89-2_1
sdf
pdb
ED_-GRI-5b13fbe2-55_4
sdf
pdb
2.5
± 0.4
RUN2054
PET-UNK-29afea89-2_1
sdf
pdb
RAL-THA-05e671eb-25_1
sdf
pdb
2.5
± 0.6
RUN1780
PET-UNK-29afea89-2_1
sdf
pdb
EDG-MED-90036822-80_2
sdf
pdb
2.5
± 0.5
RUN4969
PET-UNK-29afea89-2_1
sdf
pdb
PET-UNK-10339a1d-1_1
sdf
pdb
2.5
± 0.3
RUN4373
PET-UNK-29afea89-2_1
sdf
pdb
JOH-UNI-6e27fddc-3_1
sdf
pdb
2.5
± 0.3
RUN2722
PET-UNK-29afea89-2_1
sdf
pdb
EDG-MED-ba1ac7b9-26_3
sdf
pdb
2.5
± 0.3
RUN4359
PET-UNK-29afea89-2_1
sdf
pdb
BEN-DND-d1eb1f41-9_1
sdf
pdb
2.5
± 0.2
RUN2175
PET-UNK-29afea89-2_1
sdf
pdb
ALP-UNI-76695c4f-7_1
sdf
pdb
2.5
± 0.3
RUN4028
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-4223bc15-10_3
sdf
pdb
2.5
± 0.3
RUN1278
PET-UNK-29afea89-2_1
sdf
pdb
RAL-THA-8416115c-8_4
sdf
pdb
2.5
± 0.3
RUN1592
PET-UNK-29afea89-2_1
sdf
pdb
ED_-GRI-5b13fbe2-53_1
sdf
pdb
2.5
± 0.5
RUN4644
PET-UNK-29afea89-2_1
sdf
pdb
MIC-UNK-ea4eb352-7_2
sdf
pdb
2.5
± 0.3
RUN176
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-6344a35d-1_1
sdf
pdb
2.5
± 0.2
RUN2253
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-e9e99895-7_1
sdf
pdb
2.5
± 0.3
RUN2558
PET-UNK-29afea89-2_1
sdf
pdb
EDJ-MED-40433386-5_1
sdf
pdb
2.5
± 0.3
RUN4241
PET-UNK-29afea89-2_1
sdf
pdb
ALP-POS-347519b5-1_18
sdf
pdb
2.5
± 0.4
RUN2685
PET-UNK-29afea89-2_1
sdf
pdb
EDG-MED-ba1ac7b9-16_2
sdf
pdb
2.5
± 0.2
RUN3380
PET-UNK-29afea89-2_1
sdf
pdb
DAR-DIA-0587064e-22_1
sdf
pdb
2.5
± 0.2
RUN1955
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-c7771779-2_2
sdf
pdb
2.5
± 0.4
RUN1439
PET-UNK-29afea89-2_1
sdf
pdb
DAR-DIA-9e4459de-13_13
sdf
pdb
2.5
± 0.2
RUN2197
PET-UNK-29afea89-2_1
sdf
pdb
CHO-MSK-a31cca77-4_1
sdf
pdb
2.5
± 0.6
RUN5122
PET-UNK-29afea89-2_1
sdf
pdb
UNK-UNK-2ede4078-104_2
sdf
pdb
2.5
± 0.5
RUN2055
PET-UNK-29afea89-2_1
sdf
pdb
RAL-THA-05e671eb-25_2
sdf
pdb
2.5
± 0.7
RUN2779
PET-UNK-29afea89-2_1
sdf
pdb
ALP-UNI-dbbfd3db-11_1
sdf
pdb
2.5
± 0.3
RUN3891
PET-UNK-29afea89-2_1
sdf
pdb
RYA-UNI-14580791-1_1
sdf
pdb
2.5
± 0.3
RUN3825
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-45b13633-4_2
sdf
pdb
2.5
± 0.2
RUN4838
PET-UNK-29afea89-2_1
sdf
pdb
ALF-EVA-82cf4849-8_1
sdf
pdb
2.5
± 0.5
RUN3601
PET-UNK-29afea89-2_1
sdf
pdb
JIN-POS-6dc588a4-19_1
sdf
pdb
2.6
± 0.4
RUN1582
PET-UNK-29afea89-2_1
sdf
pdb
ED_-GRI-5b13fbe2-46_1
sdf
pdb
2.6
± 0.4
RUN2141
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-2bb0cf2b-1_1
sdf
pdb
2.6
± 0.5
RUN3132
PET-UNK-29afea89-2_1
sdf
pdb
ALP-POS-fe871b40-13_2
sdf
pdb
2.6
± 0.1
RUN4686
PET-UNK-29afea89-2_1
sdf
pdb
EDJ-MED-1981ceba-2_2
sdf
pdb
2.6
± 0.3
RUN2512
PET-UNK-29afea89-2_1
sdf
pdb
ALP-UNI-3496895b-5_1
sdf
pdb
2.6
± 0.3
RUN4262
PET-UNK-29afea89-2_1
sdf
pdb
ALP-POS-347519b5-1_63
sdf
pdb
2.6
± 0.3
RUN4269
PET-UNK-29afea89-2_1
sdf
pdb
ALP-POS-347519b5-2_22
sdf
pdb
2.6
± 0.3
RUN4886
PET-UNK-29afea89-2_1
sdf
pdb
ALP-POS-67d5babe-3_1
sdf
pdb
2.6
± 0.4
RUN4875
PET-UNK-29afea89-2_1
sdf
pdb
ALP-POS-67d5babe-1_11
sdf
pdb
2.6
± 0.5
RUN4768
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-24589f88-5_1
sdf
pdb
2.6
± 0.4
RUN2733
PET-UNK-29afea89-2_1
sdf
pdb
EDG-MED-ba1ac7b9-28_2
sdf
pdb
2.6
± 0.2
RUN1528
PET-UNK-29afea89-2_1
sdf
pdb
ED_-GRI-5b13fbe2-2_1
sdf
pdb
2.6
± 0.5
RUN4577
PET-UNK-29afea89-2_1
sdf
pdb
PET-UNK-bcc8fd08-6_1
sdf
pdb
2.6
± 0.2
RUN4008
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-4223bc15-8_7
sdf
pdb
2.6
± 0.5
RUN2619
PET-UNK-29afea89-2_1
sdf
pdb
EDG-MED-ba1ac7b9-1_3
sdf
pdb
2.6
± 0.3
RUN2560
PET-UNK-29afea89-2_1
sdf
pdb
EDJ-MED-40433386-7_1
sdf
pdb
2.6
± 0.3
RUN4088
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-4223bc15-16_15
sdf
pdb
2.6
± 0.3
RUN1200
PET-UNK-29afea89-2_1
sdf
pdb
BEN-DND-f2e727cd-6_3
sdf
pdb
2.6
± 0.6
RUN2003
PET-UNK-29afea89-2_1
sdf
pdb
RAL-THA-2d450e86-38_1
sdf
pdb
2.6
± 0.7
RUN2843
PET-UNK-29afea89-2_1
sdf
pdb
EDJ-MED-ee07cf00-17_1
sdf
pdb
2.6
± 0.1
RUN3806
PET-UNK-29afea89-2_1
sdf
pdb
DAR-DIA-4987d2cd-2_1
sdf
pdb
2.6
± 0.2
RUN1952
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-c7771779-1_2
sdf
pdb
2.6
± 0.4
RUN1395
PET-UNK-29afea89-2_1
sdf
pdb
NAU-LAT-4ce8bf23-3_2
sdf
pdb
2.6
± 0.1
RUN4773
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-24589f88-4_2
sdf
pdb
2.6
± 0.4
RUN1321
PET-UNK-29afea89-2_1
sdf
pdb
LON-WEI-5e7d1b3e-12_1
sdf
pdb
2.6
± 0.2
RUN4048
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-4223bc15-12_4
sdf
pdb
2.6
± 0.3
RUN1760
PET-UNK-29afea89-2_1
sdf
pdb
EDG-MED-90036822-71_1
sdf
pdb
2.6
± 0.5
RUN1784
PET-UNK-29afea89-2_1
sdf
pdb
EDG-MED-90036822-83_3
sdf
pdb
2.6
± 0.5
RUN4266
PET-UNK-29afea89-2_1
sdf
pdb
ALP-POS-347519b5-2_19
sdf
pdb
2.6
± 0.3
RUN1771
PET-UNK-29afea89-2_1
sdf
pdb
EDG-MED-90036822-75_2
sdf
pdb
2.6
± 0.5
RUN4887
PET-UNK-29afea89-2_1
sdf
pdb
ALP-POS-67d5babe-3_2
sdf
pdb
2.6
± 0.5
RUN4798
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-24589f88-12_1
sdf
pdb
2.6
± 0.5
RUN2208
PET-UNK-29afea89-2_1
sdf
pdb
LEE-CAM-7ab9b158-2_2
sdf
pdb
2.6
± 0.3
RUN4869
PET-UNK-29afea89-2_1
sdf
pdb
ALP-POS-67d5babe-1_4
sdf
pdb
2.6
± 0.3
RUN2745
PET-UNK-29afea89-2_1
sdf
pdb
EDG-MED-ba1ac7b9-32_2
sdf
pdb
2.6
± 0.2
RUN3718
PET-UNK-29afea89-2_1
sdf
pdb
KAD-UNI-cb0f2bbc-24_2
sdf
pdb
2.6
± 0.3
RUN664
PET-UNK-29afea89-2_1
sdf
pdb
MIC-UNK-50cce87d-6_1
sdf
pdb
2.6
± 0.2
RUN2327
PET-UNK-29afea89-2_1
sdf
pdb
ALP-POS-e0fe77e5-13_1
sdf
pdb
2.6
± 0.4
RUN2890
PET-UNK-29afea89-2_1
sdf
pdb
DAR-DIA-ecdbc7dd-5_2
sdf
pdb
2.6
± 0.1
RUN4826
PET-UNK-29afea89-2_1
sdf
pdb
ALF-EVA-82cf4849-2_1
sdf
pdb
2.6
± 0.2
RUN2031
PET-UNK-29afea89-2_1
sdf
pdb
RAL-THA-05e671eb-13_2
sdf
pdb
2.6
± 0.6
RUN2033
PET-UNK-29afea89-2_1
sdf
pdb
RAL-THA-05e671eb-14_2
sdf
pdb
2.6
± 0.4
RUN2182
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-c74bc7b3-1_1
sdf
pdb
2.6
± 0.4
RUN4865
PET-UNK-29afea89-2_1
sdf
pdb
ALP-POS-82da25a3-2_2
sdf
pdb
2.7
± 0.2
RUN3801
PET-UNK-29afea89-2_1
sdf
pdb
DAR-DIA-4987d2cd-1_1
sdf
pdb
2.7
± 0.3
RUN4009
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-4223bc15-9_1
sdf
pdb
2.7
± 0.4
RUN3563
PET-UNK-29afea89-2_1
sdf
pdb
ALP-POS-e4f7337d-1_1
sdf
pdb
2.7
± 0.2
RUN2636
PET-UNK-29afea89-2_1
sdf
pdb
EDG-MED-ba1ac7b9-6_2
sdf
pdb
2.7
± 0.5
RUN1018
PET-UNK-29afea89-2_1
sdf
pdb
MAK-UNK-c749d764-21_5
sdf
pdb
2.7
± 0.1
RUN5000
PET-UNK-29afea89-2_1
sdf
pdb
PET-UNK-ac320b15-1_1
sdf
pdb
2.7
± 0.4
RUN4299
PET-UNK-29afea89-2_1
sdf
pdb
ALP-POS-347519b5-3_6
sdf
pdb
2.7
± 0.3
RUN3873
PET-UNK-29afea89-2_1
sdf
pdb
EDJ-MED-670ad2ee-8_1
sdf
pdb
2.7
± 0.5
RUN5115
PET-UNK-29afea89-2_1
sdf
pdb
MIC-UNK-37660950-3_4
sdf
pdb
2.7
± 0.4
RUN4855
PET-UNK-29afea89-2_1
sdf
pdb
MIC-UNK-54748b58-3_2
sdf
pdb
2.7
± 0.4
RUN3001
PET-UNK-29afea89-2_1
sdf
pdb
ALP-UNI-8e43a71e-15_19
sdf
pdb
2.7
± 0.3
RUN4529
PET-UNK-29afea89-2_1
sdf
pdb
ALP-POS-e6e0c683-4_2
sdf
pdb
2.7
± 0.4
RUN1674
PET-UNK-29afea89-2_1
sdf
pdb
EDG-MED-90036822-12_2
sdf
pdb
2.7
± 0.1
RUN1266
PET-UNK-29afea89-2_1
sdf
pdb
RAL-THA-8416115c-5_4
sdf
pdb
2.7
± 0.1
RUN4721
PET-UNK-29afea89-2_1
sdf
pdb
EDJ-MED-c82a5324-1_3
sdf
pdb
2.7
± 0.3
RUN730
PET-UNK-29afea89-2_1
sdf
pdb
MAK-UNK-83e0a0b4-2_1
sdf
pdb
2.7
± 0.1
RUN4156
PET-UNK-29afea89-2_1
sdf
pdb
MAT-POS-4223bc15-37_2
sdf
pdb
2.7
± 0.4
Last updated 2021-06-04T18:13:56.580002+00:00
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