COVID Moonshot Sprint 12
Summary
Compounds
Microstates
Transformations
Reliable Transformations
(current)
Retrospective Transformations
Retrospective Compounds
Reliable Transformations
Showing 1001 through 1087 of 87
RUN
Atom map
Initial microstate
Final microstate
ΔΔG / kcal M
-1
Work distribution
Bootstrapping
Convergence
RUN1538
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-cc48ee33-4_1
pdb
10.3
± 0.7
RUN1704
map
MAT-POS-c7726e07-5_1
pdb
VLA-UNK-e334495f-1_1
pdb
10.3
± 0.9
RUN1686
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-5cd3920d-5_1
pdb
10.4
± 0.9
RUN2018
map
MAT-POS-c7726e07-5_1
pdb
MIC-UNK-257d841f-2_1
pdb
10.4
± 0.8
RUN2046
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-853c0ffa-9_1
pdb
10.4
± 1.0
RUN1705
map
MAT-POS-c7726e07-5_1
pdb
LUO-POS-e1dab717-12_1
pdb
10.5
± 0.8
RUN1939
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-5cd3920d-2_1
pdb
10.5
± 0.9
RUN1660
map
MAT-POS-c7726e07-5_1
pdb
ALP-POS-ecbed2ba-8_1
pdb
11
± 1
RUN2123
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-40ad851a-3_1
pdb
10.7
± 0.5
RUN2077
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-dfa1d800-1_1
pdb
10.7
± 0.8
RUN1823
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-50a80394-2_2
pdb
10.7
± 0.7
RUN1980
map
MAT-POS-c7726e07-5_1
pdb
MIC-UNK-257d841f-1_2
pdb
10.8
± 0.7
RUN2013
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-4138fde9-5_1
pdb
10.8
± 0.7
RUN1111
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-d4864bdc-3_1
pdb
10.9
± 0.6
RUN1390
map
MAT-POS-c7726e07-5_1
pdb
ALP-POS-ecbed2ba-3_1
pdb
10.9
± 0.8
RUN1904
map
MAT-POS-c7726e07-5_1
pdb
MIK-ENA-17e27e9c-1_2
pdb
11.0
± 0.8
RUN1537
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-cc48ee33-4_1
pdb
11.1
± 0.6
RUN1662
map
MAT-POS-c7726e07-5_1
pdb
ALP-POS-ecbed2ba-22_1
pdb
11.1
± 0.8
RUN1702
map
MAT-POS-c7726e07-5_1
pdb
LUO-POS-e1dab717-6_1
pdb
11.1
± 0.8
RUN1956
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-4138fde9-3_2
pdb
11.2
± 0.9
RUN1293
map
MAT-POS-c7726e07-5_1
pdb
ALP-POS-afe0272e-2_1
pdb
11.2
± 0.7
RUN1092
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-983b399a-1_1
pdb
11.2
± 0.8
RUN2033
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-ee81482e-1_1
pdb
11
± 1
RUN1641
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-b4d6b7fc-7_2
pdb
11.2
± 0.4
RUN1992
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-853c0ffa-12_1
pdb
11.2
± 0.8
RUN1389
map
MAT-POS-c7726e07-5_1
pdb
ALP-POS-ecbed2ba-3_1
pdb
11.3
± 1.0
RUN1157
map
MAT-POS-c7726e07-5_1
pdb
LUO-POS-ed2cfb03-2_1
pdb
11.3
± 0.6
RUN1264
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-94fddcec-7_1
pdb
11.4
± 0.7
RUN1908
map
MAT-POS-c7726e07-5_1
pdb
MIK-ENA-2c0ad173-1_1
pdb
11.4
± 0.8
RUN1154
map
MAT-POS-c7726e07-5_1
pdb
LUO-POS-ed2cfb03-2_1
pdb
11.5
± 0.8
RUN2158
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-dfa1d800-3_1
pdb
11.5
± 0.7
RUN1678
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-be048f2c-8_1
pdb
11.5
± 0.7
RUN1420
map
MAT-POS-c7726e07-5_1
pdb
PET-UNK-94036022-3_1
pdb
11.6
± 0.9
RUN1961
map
MAT-POS-c7726e07-5_1
pdb
PET-UNK-c6bcc80b-6_1
pdb
11.6
± 0.8
RUN1902
map
MAT-POS-c7726e07-5_1
pdb
MIK-ENA-17e27e9c-1_2
pdb
11.7
± 1.0
RUN2017
map
MAT-POS-c7726e07-5_1
pdb
MIC-UNK-257d841f-2_1
pdb
11.7
± 0.7
RUN1515
map
MAT-POS-c7726e07-5_1
pdb
ALP-POS-ecbed2ba-21_1
pdb
12
± 1
RUN1118
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-7587a9ee-3_1
pdb
11.7
± 0.7
RUN2142
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-468565e0-2_1
pdb
12
± 1
RUN1528
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-38eb6498-5_1
pdb
11.8
± 0.6
RUN2134
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-4138fde9-6_1
pdb
12.0
± 0.7
RUN2044
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-9f4ac58c-7_1
pdb
12.1
± 0.9
RUN1511
map
MAT-POS-c7726e07-5_1
pdb
ALP-POS-ecbed2ba-21_1
pdb
12.2
± 1.0
RUN1105
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-f9b78f78-4_1
pdb
12.2
± 0.7
RUN1465
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-3707c4bc-2_1
pdb
12.3
± 0.9
RUN1844
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-b6c6ee2b-3_1
pdb
12.3
± 0.7
RUN1661
map
MAT-POS-c7726e07-5_1
pdb
ALP-POS-ecbed2ba-22_1
pdb
12.4
± 0.7
RUN2043
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-9f4ac58c-7_1
pdb
12.4
± 0.8
RUN1425
map
MAT-POS-c7726e07-5_1
pdb
VLA-UNK-f2612802-2_1
pdb
12.4
± 0.7
RUN1396
map
MAT-POS-c7726e07-5_1
pdb
ALP-POS-ecbed2ba-19_1
pdb
12.4
± 0.9
RUN1854
map
MAT-POS-c7726e07-5_1
pdb
LUO-POS-e1dab717-16_1
pdb
12.4
± 0.8
RUN2144
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-468565e0-5_1
pdb
12.5
± 0.8
RUN2145
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-468565e0-2_1
pdb
12
± 1
RUN2072
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-ee81482e-4_1
pdb
13
± 1
RUN1669
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-98c0a822-1_1
pdb
12.8
± 1.0
RUN2135
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-4138fde9-6_1
pdb
12.8
± 0.8
RUN2150
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-468565e0-5_1
pdb
13
± 1
RUN2146
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-468565e0-5_1
pdb
12.8
± 1.0
RUN1685
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-5cd3920d-5_1
pdb
13.0
± 0.8
RUN1708
map
MAT-POS-c7726e07-5_1
pdb
LUO-POS-e1dab717-12_1
pdb
13.1
± 0.9
RUN2148
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-4138fde9-2_1
pdb
13.2
± 0.8
RUN1974
map
MAT-POS-c7726e07-5_1
pdb
MIK-ENA-edcfce18-1_2
pdb
13.3
± 0.7
RUN1513
map
MAT-POS-c7726e07-5_1
pdb
ALP-POS-ecbed2ba-16_1
pdb
13.3
± 0.8
RUN2037
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-4138fde9-1_1
pdb
13.4
± 0.9
RUN1858
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-4138fde9-7_1
pdb
13.4
± 0.8
RUN1873
map
MAT-POS-c7726e07-5_1
pdb
ALP-POS-c3a90b22-9_1
pdb
13.5
± 0.6
RUN1514
map
MAT-POS-c7726e07-5_1
pdb
ALP-POS-ecbed2ba-16_1
pdb
14
± 1
RUN2047
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-853c0ffa-9_1
pdb
13.6
± 0.9
RUN1121
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-7587a9ee-3_1
pdb
13.9
± 0.8
RUN1855
map
MAT-POS-c7726e07-5_1
pdb
LUO-POS-e1dab717-16_1
pdb
14.0
± 0.9
RUN1109
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-f9b78f78-4_1
pdb
14.1
± 0.6
RUN2097
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-1a788f51-3_1
pdb
15
± 1
RUN1809
map
MAT-POS-c7726e07-5_1
pdb
ALP-POS-ecbed2ba-15_1
pdb
14.7
± 0.9
RUN1318
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-ede5c6cb-1_1
pdb
14.9
± 0.8
RUN1861
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-4138fde9-7_1
pdb
15.0
± 0.9
RUN2076
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-ee81482e-4_1
pdb
15.0
± 1.0
RUN1395
map
MAT-POS-c7726e07-5_1
pdb
ALP-POS-ecbed2ba-19_1
pdb
15.0
± 1.0
RUN1821
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-50a80394-2_1
pdb
15.4
± 0.6
RUN2066
map
MAT-POS-c7726e07-5_1
pdb
PET-UNK-c6bcc80b-11_1
pdb
15.8
± 1.0
RUN2067
map
MAT-POS-c7726e07-5_1
pdb
PET-UNK-c6bcc80b-11_1
pdb
15.8
± 0.8
RUN1859
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-4138fde9-7_1
pdb
15.9
± 0.9
RUN1822
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-50a80394-2_1
pdb
16.4
± 0.9
RUN2075
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-dfa1d800-1_1
pdb
17.1
± 0.8
RUN1973
map
MAT-POS-c7726e07-5_1
pdb
MIK-ENA-edcfce18-1_2
pdb
17.4
± 0.8
RUN2040
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-4138fde9-1_1
pdb
18
± 1
RUN1967
map
MAT-POS-c7726e07-5_1
pdb
MIK-ENA-e143773d-1_1
pdb
18.4
± 0.5
RUN1907
map
MAT-POS-c7726e07-5_1
pdb
MIK-ENA-2c0ad173-1_1
pdb
20.1
± 0.5
Last updated 2022-02-23T18:30:14.352717+00:00
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