COVID Moonshot Sprint 11
Summary
Compounds
Microstates
Transformations
Reliable Transformations
(current)
Retrospective Transformations
Retrospective Compounds
Reliable Transformations
Showing 301 through 400 of 100
RUN
Atom map
Initial microstate
Final microstate
ΔΔG / kcal M
-1
Work distribution
Bootstrapping
Convergence
RUN1797
map
VLA-UCB-50c39ae8-2_1
pdb
PET-UNK-94036022-4_1
pdb
1.7
± 0.5
RUN1562
map
VLA-UCB-50c39ae8-2_1
pdb
EDJ-MED-94fddcec-5_1
pdb
1.7
± 0.2
RUN1841
map
VLA-UCB-50c39ae8-2_1
pdb
PET-UNK-94036022-6_1
pdb
1.7
± 0.6
RUN1870
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-853c0ffa-12_1
pdb
1.7
± 0.5
RUN1511
map
VLA-UCB-50c39ae8-2_1
pdb
EDJ-MED-7587a9ee-3_1
pdb
1.7
± 0.2
RUN1738
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-38eb6498-5_2
pdb
1.7
± 0.3
RUN1602
map
VLA-UCB-50c39ae8-2_1
pdb
ALP-POS-ecbed2ba-14_2
pdb
1.7
± 0.3
RUN1546
map
VLA-UCB-50c39ae8-2_1
pdb
EDJ-MED-7587a9ee-1_1
pdb
1.8
± 0.2
RUN1697
map
VLA-UCB-50c39ae8-2_1
pdb
ALP-POS-ecbed2ba-6_2
pdb
1.8
± 0.4
RUN1889
map
VLA-UCB-50c39ae8-2_1
pdb
EDJ-MED-5cd3920d-1_2
pdb
1.8
± 0.7
RUN1763
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-853c0ffa-7_2
pdb
1.8
± 0.3
RUN1568
map
VLA-UCB-50c39ae8-2_1
pdb
ALP-POS-afe0272e-1_1
pdb
1.8
± 0.3
RUN1913
map
VLA-UCB-50c39ae8-2_1
pdb
EDJ-MED-ee81482e-3_1
pdb
1.8
± 0.8
RUN1744
map
VLA-UCB-50c39ae8-2_1
pdb
PET-UNK-94036022-2_2
pdb
1.8
± 0.5
RUN1846
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-50a80394-3_1
pdb
1.8
± 0.7
RUN1535
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-c7726e07-5_2
pdb
1.8
± 0.2
RUN1475
map
VLA-UCB-50c39ae8-2_1
pdb
EDJ-MED-e78d5f1a-1_2
pdb
1.8
± 0.1
RUN1758
map
VLA-UCB-50c39ae8-2_1
pdb
LUO-POS-868e8996-10_2
pdb
1.8
± 0.5
RUN1502
map
VLA-UCB-50c39ae8-2_1
pdb
EDJ-MED-94fddcec-4_1
pdb
1.8
± 0.2
RUN1752
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-1bed62cf-1_1
pdb
1.8
± 0.4
RUN1557
map
VLA-UCB-50c39ae8-2_1
pdb
LUO-POS-ed2cfb03-2_1
pdb
1.9
± 0.3
RUN1693
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-853c0ffa-17_1
pdb
1.9
± 0.4
RUN1497
map
VLA-UCB-50c39ae8-2_1
pdb
VLA-MRT-8c78ee15-2_1
pdb
1.9
± 0.2
RUN1896
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-853c0ffa-9_1
pdb
1.9
± 0.5
RUN1538
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-c7726e07-5_1
pdb
1.9
± 0.3
RUN1628
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-576f7758-1_2
pdb
1.9
± 0.3
RUN1585
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-50a80394-4_4
pdb
1.9
± 0.2
RUN1788
map
VLA-UCB-50c39ae8-2_1
pdb
EDJ-MED-a12e3a20-1_1
pdb
1.9
± 0.4
RUN1505
map
VLA-UCB-50c39ae8-2_1
pdb
JOH-MSK-51c67e7d-1_1
pdb
1.9
± 0.2
RUN1464
map
VLA-UCB-50c39ae8-2_1
pdb
EDJ-MED-159244ea-2_1
pdb
1.9
± 0.1
RUN1945
map
VLA-UCB-50c39ae8-2_1
pdb
EDJ-MED-468565e0-3_2
pdb
1.9
± 0.6
RUN1667
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-69786b79-3_1
pdb
1.9
± 0.4
RUN1751
map
VLA-UCB-50c39ae8-2_1
pdb
PET-UNK-94036022-12_2
pdb
1.9
± 0.4
RUN1725
map
VLA-UCB-50c39ae8-2_1
pdb
MIK-ENA-5d9157e9-2_1
pdb
1.9
± 0.5
RUN1700
map
VLA-UCB-50c39ae8-2_1
pdb
ALP-POS-ecbed2ba-9_2
pdb
2.0
± 0.7
RUN1684
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-50a80394-6_3
pdb
2.0
± 0.3
RUN1921
map
VLA-UCB-50c39ae8-2_1
pdb
EDJ-MED-ee81482e-5_2
pdb
2.0
± 0.5
RUN1524
map
VLA-UCB-50c39ae8-2_1
pdb
VLA-MRT-8c78ee15-4_1
pdb
2.0
± 0.3
RUN1556
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-2e8b2191-8_2
pdb
2.0
± 0.2
RUN1530
map
VLA-UCB-50c39ae8-2_1
pdb
EDJ-MED-8bb691af-4_2
pdb
2.0
± 0.3
RUN1704
map
VLA-UCB-50c39ae8-2_1
pdb
ALP-POS-ecbed2ba-6_1
pdb
2.0
± 0.4
RUN1509
map
VLA-UCB-50c39ae8-2_1
pdb
JOH-MSK-51c67e7d-2_2
pdb
2.0
± 0.1
RUN1777
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-1d5ab790-1_1
pdb
2.0
± 0.6
RUN1796
map
VLA-UCB-50c39ae8-2_1
pdb
EDJ-MED-b6c6ee2b-4_2
pdb
2.0
± 0.5
RUN1822
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-853c0ffa-8_2
pdb
2.0
± 0.4
RUN1593
map
VLA-UCB-50c39ae8-2_1
pdb
JOH-MSK-1f2dff76-1_2
pdb
2.0
± 0.2
RUN1569
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-1d5ab790-2_1
pdb
2.1
± 0.3
RUN1947
map
VLA-UCB-50c39ae8-2_1
pdb
EDJ-MED-468565e0-4_1
pdb
2.1
± 0.8
RUN1815
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-853c0ffa-6_2
pdb
2.1
± 0.5
RUN1508
map
VLA-UCB-50c39ae8-2_1
pdb
JOH-MSK-51c67e7d-1_2
pdb
2.1
± 0.1
RUN1829
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-c2d406ed-4_2
pdb
2.1
± 0.3
RUN1582
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-50a80394-4_1
pdb
2.1
± 0.3
RUN1791
map
VLA-UCB-50c39ae8-2_1
pdb
EDJ-MED-98c0a822-1_2
pdb
2.1
± 0.4
RUN1699
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-853c0ffa-21_1
pdb
2.1
± 0.3
RUN1564
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-b4d6b7fc-5_2
pdb
2.1
± 0.3
RUN1677
map
VLA-UCB-50c39ae8-2_1
pdb
PET-UNK-94036022-10_2
pdb
2.1
± 0.4
RUN1831
map
VLA-UCB-50c39ae8-2_1
pdb
EDJ-MED-5cd3920d-6_2
pdb
2.1
± 0.7
RUN1510
map
VLA-UCB-50c39ae8-2_1
pdb
EDJ-MED-7587a9ee-3_2
pdb
2.2
± 0.3
RUN1551
map
VLA-UCB-50c39ae8-2_1
pdb
VLA-MRT-8c78ee15-3_1
pdb
2.2
± 0.3
RUN1600
map
VLA-UCB-50c39ae8-2_1
pdb
ALP-POS-ecbed2ba-7_2
pdb
2.2
± 0.2
RUN1874
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-853c0ffa-11_2
pdb
2.2
± 0.6
RUN1573
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-1d5ab790-2_2
pdb
2.2
± 0.3
RUN1558
map
VLA-UCB-50c39ae8-2_1
pdb
VLA-MRT-a639d434-1_2
pdb
2.2
± 0.3
RUN1864
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-853c0ffa-15_2
pdb
2.2
± 0.6
RUN1803
map
VLA-UCB-50c39ae8-2_1
pdb
EDJ-MED-5cd3920d-5_1
pdb
2.3
± 0.5
RUN1715
map
VLA-UCB-50c39ae8-2_1
pdb
ALP-POS-ecbed2ba-13_1
pdb
2.3
± 0.5
RUN1850
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-853c0ffa-22_2
pdb
2.3
± 0.7
RUN1466
map
VLA-UCB-50c39ae8-2_1
pdb
EDJ-MED-a6bab6fb-1_2
pdb
2.3
± 0.1
RUN1589
map
VLA-UCB-50c39ae8-2_1
pdb
LUO-POS-b4dec3be-2_2
pdb
2.3
± 0.3
RUN1670
map
VLA-UCB-50c39ae8-2_1
pdb
ALP-POS-ecbed2ba-19_1
pdb
2.3
± 0.4
RUN1655
map
VLA-UCB-50c39ae8-2_1
pdb
EDJ-MED-8bb691af-2_2
pdb
2.4
± 0.4
RUN1586
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-96396902-1_2
pdb
2.4
± 0.3
RUN1884
map
VLA-UCB-50c39ae8-2_1
pdb
EDJ-MED-5cd3920d-1_1
pdb
2.4
± 0.5
RUN1590
map
VLA-UCB-50c39ae8-2_1
pdb
LUO-POS-b4dec3be-1_2
pdb
2.4
± 0.3
RUN1828
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-50a80394-8_2
pdb
2.4
± 0.9
RUN1555
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-1bed62cf-3_2
pdb
2.4
± 0.2
RUN1770
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-853c0ffa-14_2
pdb
2.4
± 0.3
RUN1640
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-50a80394-7_2
pdb
2.4
± 0.3
RUN1843
map
VLA-UCB-50c39ae8-2_1
pdb
PET-UNK-94036022-6_2
pdb
2.4
± 0.6
RUN1634
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-50a80394-5_3
pdb
2.5
± 0.3
RUN1789
map
VLA-UCB-50c39ae8-2_1
pdb
EDJ-MED-98c0a822-1_1
pdb
2.5
± 0.5
RUN1500
map
VLA-UCB-50c39ae8-2_1
pdb
VLA-MRT-a639d434-3_1
pdb
2.5
± 0.2
RUN1799
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-50a80394-1_3
pdb
2.5
± 0.3
RUN1695
map
VLA-UCB-50c39ae8-2_1
pdb
EDJ-MED-8bb691af-5_2
pdb
2.5
± 0.5
RUN1918
map
VLA-UCB-50c39ae8-2_1
pdb
EDJ-MED-ee81482e-3_4
pdb
2.5
± 0.8
RUN1461
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-983b399a-2_2
pdb
2.5
± 0.1
RUN1683
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-50a80394-6_2
pdb
2.5
± 0.3
RUN1760
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-853c0ffa-5_1
pdb
2.6
± 0.6
RUN1473
map
VLA-UCB-50c39ae8-2_1
pdb
EDJ-MED-f3cfbbb5-1_2
pdb
2.6
± 0.1
RUN1845
map
VLA-UCB-50c39ae8-2_1
pdb
PET-UNK-94036022-13_1
pdb
2.6
± 0.6
RUN1936
map
VLA-UCB-50c39ae8-2_1
pdb
EDJ-MED-468565e0-5_1
pdb
2.6
± 0.8
RUN1836
map
VLA-UCB-50c39ae8-2_1
pdb
EDJ-MED-5cd3920d-6_1
pdb
2.6
± 0.4
RUN1492
map
VLA-UCB-50c39ae8-2_1
pdb
VLA-MRT-8c78ee15-1_1
pdb
2.7
± 0.2
RUN1661
map
VLA-UCB-50c39ae8-2_1
pdb
ALP-POS-ecbed2ba-3_2
pdb
2.7
± 0.4
RUN1476
map
VLA-UCB-50c39ae8-2_1
pdb
EDJ-MED-e78d5f1a-1_1
pdb
2.7
± 0.1
RUN1463
map
VLA-UCB-50c39ae8-2_1
pdb
EDJ-MED-159244ea-2_2
pdb
2.8
± 0.1
RUN1682
map
VLA-UCB-50c39ae8-2_1
pdb
ALP-POS-ecbed2ba-19_3
pdb
3
± 1
RUN1809
map
VLA-UCB-50c39ae8-2_1
pdb
LUO-POS-eaf50f21-1_1
pdb
2.8
± 0.4
RUN1685
map
VLA-UCB-50c39ae8-2_1
pdb
PET-UNK-94036022-3_2
pdb
2.8
± 0.3
RUN1646
map
VLA-UCB-50c39ae8-2_1
pdb
PET-UNK-94036022-7_2
pdb
2.8
± 0.3
Last updated 2022-01-08T06:54:59.612175+00:00
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