COVID Moonshot Sprint 12
Summary
Compounds
Microstates
Transformations
Reliable Transformations
(current)
Retrospective Transformations
Retrospective Compounds
Reliable Transformations
Showing 501 through 600 of 100
RUN
Atom map
Initial microstate
Final microstate
ΔΔG / kcal M
-1
Work distribution
Bootstrapping
Convergence
RUN1220
map
MAT-POS-c7726e07-5_1
pdb
JOH-MSK-1f2dff76-1_2
pdb
0.8
± 0.4
RUN1616
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-e75f6e44-3_2
pdb
0.8
± 0.4
RUN1186
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-1d5ab790-2_2
pdb
0.8
± 0.3
RUN1242
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-accc2c4d-3_1
pdb
0.8
± 0.6
RUN1286
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-69786b79-2_1
pdb
0.8
± 0.3
RUN1200
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-50a80394-4_4
pdb
0.8
± 0.3
RUN1500
map
MAT-POS-c7726e07-5_1
pdb
ALP-POS-ecbed2ba-4_1
pdb
0.8
± 0.9
RUN1920
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-33064c06-10_1
pdb
0.8
± 0.3
RUN1733
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-59d5ca70-2_2
pdb
0.8
± 0.6
RUN1664
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-38eb6498-6_1
pdb
0.8
± 0.3
RUN1755
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-e75f6e44-9_2
pdb
0.8
± 0.4
RUN2138
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-40ad851a-5_1
pdb
0.8
± 0.9
RUN1569
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-4138fde9-9_1
pdb
0.9
± 0.8
RUN1567
map
MAT-POS-c7726e07-5_1
pdb
VLA-UNK-5d8210f0-4_1
pdb
0.9
± 0.4
RUN1178
map
MAT-POS-c7726e07-5_1
pdb
ALP-POS-afe0272e-1_2
pdb
0.9
± 0.3
RUN1933
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-50a80394-3_1
pdb
0.9
± 0.7
RUN1757
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-e75f6e44-11_1
pdb
0.9
± 0.4
RUN1158
map
MAT-POS-c7726e07-5_1
pdb
VLA-UNK-3bd6fc51-1_1
pdb
0.9
± 0.3
RUN1091
map
MAT-POS-c7726e07-5_1
pdb
ALP-POS-477dc5b7-4_1
pdb
0.9
± 0.2
RUN1304
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-50a80394-5_3
pdb
0.9
± 0.3
RUN1159
map
MAT-POS-c7726e07-5_1
pdb
VLA-UNK-3bd6fc51-1_1
pdb
0.9
± 0.2
RUN1124
map
MAT-POS-c7726e07-5_1
pdb
PET-UNK-aa57768f-8_1
pdb
0.9
± 0.3
RUN2139
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-40ad851a-5_1
pdb
1
± 1
RUN1889
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-e75f6e44-20_1
pdb
0.9
± 0.6
RUN1635
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-33064c06-13_1
pdb
0.9
± 0.3
RUN1180
map
MAT-POS-c7726e07-5_1
pdb
ALP-POS-afe0272e-1_1
pdb
0.91
± 0.09
RUN1437
map
MAT-POS-c7726e07-5_1
pdb
PET-UNK-6af7266d-4_1
pdb
0.9
± 0.2
RUN1089
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-159244ea-1_1
pdb
0.9
± 0.3
RUN1322
map
MAT-POS-c7726e07-5_1
pdb
PET-UNK-94036022-7_2
pdb
0.9
± 0.4
RUN1656
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-853c0ffa-18_1
pdb
0.9
± 0.8
RUN1580
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-6b23330e-2_1
pdb
0.9
± 0.2
RUN1769
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-e75f6e44-15_2
pdb
1.0
± 0.5
RUN1744
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-e75f6e44-9_2
pdb
1.0
± 0.3
RUN1348
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-566864e2-3_1
pdb
1.0
± 0.2
RUN1879
map
MAT-POS-c7726e07-5_1
pdb
MIK-ENA-60569a44-1_1
pdb
1.0
± 0.8
RUN1735
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-e75f6e44-6_1
pdb
1.0
± 0.2
RUN1611
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-e75f6e44-2_2
pdb
1.0
± 0.4
RUN1993
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-38eb6498-2_1
pdb
1.0
± 0.8
RUN1353
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-566864e2-4_1
pdb
1.0
± 0.2
RUN1637
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-e75f6e44-14_2
pdb
1.0
± 0.4
RUN1594
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-6b23330e-7_2
pdb
1.1
± 0.4
RUN1160
map
MAT-POS-c7726e07-5_1
pdb
VLA-UNK-3bd6fc51-1_1
pdb
1.1
± 0.2
RUN1618
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-e75f6e44-3_1
pdb
1.1
± 0.3
RUN1984
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-33064c06-5_1
pdb
1.1
± 0.4
RUN1489
map
MAT-POS-c7726e07-5_1
pdb
ALP-POS-c3a90b22-4_2
pdb
1.1
± 0.3
RUN1195
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-50a80394-4_3
pdb
1.1
± 0.3
RUN1765
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-e75f6e44-12_1
pdb
1.1
± 0.3
RUN1987
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-33064c06-5_1
pdb
1.1
± 0.4
RUN1561
map
MAT-POS-c7726e07-5_1
pdb
LUO-POS-e1dab717-5_1
pdb
1.1
± 0.3
RUN2020
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-1a788f51-1_1
pdb
1.1
± 0.8
RUN1955
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-4138fde9-3_1
pdb
1.1
± 0.6
RUN2015
map
MAT-POS-c7726e07-5_1
pdb
MIC-UNK-257d841f-2_2
pdb
1.2
± 1.0
RUN1247
map
MAT-POS-c7726e07-5_1
pdb
ALP-POS-c3a90b22-6_2
pdb
1.2
± 0.4
RUN1789
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-33064c06-1_1
pdb
1.2
± 0.4
RUN1099
map
MAT-POS-c7726e07-5_1
pdb
DAR-DIA-0f7b7cd9-9_1
pdb
1.2
± 0.3
RUN1853
map
MAT-POS-c7726e07-5_1
pdb
LUO-POS-e1dab717-9_2
pdb
1.2
± 0.4
RUN2132
map
MAT-POS-c7726e07-5_1
pdb
LUO-POS-d1147590-1_1
pdb
1.2
± 0.9
RUN1095
map
MAT-POS-c7726e07-5_1
pdb
DAR-DIA-0f7b7cd9-9_1
pdb
1.2
± 0.4
RUN1586
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-6b23330e-4_1
pdb
1.2
± 0.8
RUN1462
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-accc2c4d-4_1
pdb
1.2
± 0.7
RUN1784
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-e75f6e44-19_1
pdb
1.2
± 0.5
RUN1337
map
MAT-POS-c7726e07-5_1
pdb
12_-111-3e02a1cd-2_1
pdb
1.2
± 0.3
RUN1415
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-50a80394-6_4
pdb
1.2
± 0.4
RUN1132
map
MAT-POS-c7726e07-5_1
pdb
LUO-POS-e1dab717-19_1
pdb
1.3
± 0.2
RUN1226
map
MAT-POS-c7726e07-5_1
pdb
JOH-MSK-1f2dff76-2_2
pdb
1.3
± 0.4
RUN1965
map
MAT-POS-c7726e07-5_1
pdb
MIK-ENA-edcfce18-1_1
pdb
1.3
± 0.7
RUN1088
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-159244ea-1_1
pdb
1.3
± 0.3
RUN1090
map
MAT-POS-c7726e07-5_1
pdb
ALP-POS-477dc5b7-4_1
pdb
1.3
± 0.2
RUN1497
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-8bb691af-6_1
pdb
1.3
± 0.8
RUN1761
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-e75f6e44-11_1
pdb
1.3
± 0.3
RUN1672
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-98c0a822-2_1
pdb
1.3
± 0.6
RUN1751
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-e75f6e44-9_3
pdb
1.3
± 0.6
RUN2073
map
MAT-POS-c7726e07-5_1
pdb
MIK-ENA-8063e9dc-1_1
pdb
1.3
± 0.8
RUN1421
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-d4864bdc-4_1
pdb
1.4
± 0.5
RUN1516
map
MAT-POS-c7726e07-5_1
pdb
MIK-ENA-5d9157e9-1_1
pdb
1.4
± 0.6
RUN1903
map
MAT-POS-c7726e07-5_1
pdb
MIK-ENA-623fe2a6-1_1
pdb
1.4
± 0.8
RUN1110
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-94fddcec-4_1
pdb
1.4
± 0.4
RUN1131
map
MAT-POS-c7726e07-5_1
pdb
LUO-POS-e1dab717-19_1
pdb
1.4
± 0.2
RUN1563
map
MAT-POS-c7726e07-5_1
pdb
VLA-UNK-8e615992-5_2
pdb
1.4
± 0.4
RUN1609
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-e75f6e44-1_1
pdb
1.4
± 0.2
RUN1155
map
MAT-POS-c7726e07-5_1
pdb
PET-UNK-626a1084-1_1
pdb
1.4
± 0.3
RUN1243
map
MAT-POS-c7726e07-5_1
pdb
ALP-POS-c3a90b22-6_2
pdb
1.4
± 0.3
RUN1280
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-69786b79-1_2
pdb
1.4
± 0.3
RUN2153
map
MAT-POS-c7726e07-5_1
pdb
MIC-UNK-c85ea37c-3_1
pdb
1.4
± 0.8
RUN1107
map
MAT-POS-c7726e07-5_1
pdb
ALP-POS-41e2080f-1_1
pdb
1.5
± 0.4
RUN1650
map
MAT-POS-c7726e07-5_1
pdb
LUO-POS-868e8996-10_1
pdb
1.5
± 0.8
RUN1112
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-94fddcec-4_1
pdb
1.5
± 0.4
RUN1266
map
MAT-POS-c7726e07-5_1
pdb
ALP-POS-ecbed2ba-7_1
pdb
1.5
± 0.5
RUN2035
map
MAT-POS-c7726e07-5_1
pdb
LUO-POS-e1dab717-8_1
pdb
1.5
± 0.5
RUN1341
map
MAT-POS-c7726e07-5_1
pdb
PET-UNK-77d5678a-4_2
pdb
1.5
± 0.4
RUN1098
map
MAT-POS-c7726e07-5_1
pdb
VLA-UCB-50c39ae8-2_1
pdb
1.5
± 0.2
RUN1745
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-e75f6e44-8_1
pdb
1.5
± 0.5
RUN1658
map
MAT-POS-c7726e07-5_1
pdb
ALP-POS-ecbed2ba-8_1
pdb
1.5
± 1.0
RUN1488
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-40e596c8-3_1
pdb
1.5
± 0.8
RUN1491
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-40e596c8-3_1
pdb
1.5
± 0.6
RUN1508
map
MAT-POS-c7726e07-5_1
pdb
ALP-POS-ecbed2ba-9_1
pdb
1.5
± 0.9
RUN1734
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-40e596c8-5_1
pdb
1.6
± 0.4
RUN1699
map
MAT-POS-c7726e07-5_1
pdb
VLA-UNK-61877630-7_1
pdb
1.6
± 0.8
RUN1551
map
MAT-POS-c7726e07-5_1
pdb
PET-UNK-94036022-9_1
pdb
1.6
± 0.7
RUN1605
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-40e596c8-2_2
pdb
1.6
± 0.4
Last updated 2022-02-23T02:55:47.120831+00:00
Generated by
fah-xchem
version pre-sprint-5+177.gc0e6636.dirty