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
RUN749
map
VLA-UCB-50c39ae8-2_1
pdb
MIK-ENA-5d9157e9-1_1
pdb
3.5
± 0.5
RUN660
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-50a80394-5_3
pdb
3.5
± 0.3
RUN951
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-40ad851a-1_1
pdb
3.6
± 0.5
RUN658
map
VLA-UCB-50c39ae8-2_1
pdb
EDJ-MED-b6c6ee2b-2_2
pdb
3.6
± 0.3
RUN497
map
VLA-UCB-50c39ae8-2_1
pdb
BEN-BAS-c2bc0d80-3_1
pdb
3.6
± 0.2
RUN565
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-c7726e07-6_1
pdb
3.6
± 0.3
RUN826
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-50a80394-1_2
pdb
3.6
± 0.5
RUN724
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-853c0ffa-17_2
pdb
3.6
± 0.3
RUN665
map
VLA-UCB-50c39ae8-2_1
pdb
EDJ-MED-b6c6ee2b-2_1
pdb
3.6
± 0.3
RUN844
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-853c0ffa-8_1
pdb
3.6
± 0.3
RUN608
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-50a80394-4_1
pdb
3.6
± 0.2
RUN894
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-853c0ffa-16_2
pdb
3.6
± 0.5
RUN934
map
VLA-UCB-50c39ae8-2_1
pdb
EDJ-MED-ee81482e-4_1
pdb
3.7
± 0.4
RUN755
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-69786b79-4_1
pdb
3.7
± 0.3
RUN638
map
VLA-UCB-50c39ae8-2_1
pdb
ALP-POS-ecbed2ba-18_1
pdb
3.7
± 0.4
RUN539
map
VLA-UCB-50c39ae8-2_1
pdb
EDJ-MED-f9b78f78-4_1
pdb
3.7
± 0.2
RUN919
map
VLA-UCB-50c39ae8-2_1
pdb
EDJ-MED-ee81482e-4_2
pdb
3.7
± 0.6
RUN821
map
VLA-UCB-50c39ae8-2_1
pdb
EDJ-MED-98c0a822-2_2
pdb
3.7
± 0.2
RUN925
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-853c0ffa-10_2
pdb
3.7
± 0.5
RUN956
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-40ad851a-1_8
pdb
3.7
± 0.6
RUN645
map
VLA-UCB-50c39ae8-2_1
pdb
ALP-POS-ecbed2ba-20_1
pdb
3.7
± 0.5
RUN656
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-50a80394-7_1
pdb
3.7
± 0.3
RUN538
map
VLA-UCB-50c39ae8-2_1
pdb
ALP-POS-4483ae88-1_1
pdb
3.8
± 0.1
RUN793
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-853c0ffa-18_2
pdb
3.8
± 0.3
RUN820
map
VLA-UCB-50c39ae8-2_1
pdb
EDJ-MED-98c0a822-2_1
pdb
3.8
± 0.2
RUN808
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-1d5ab790-1_2
pdb
3.8
± 0.4
RUN872
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-50a80394-3_1
pdb
3.8
± 0.4
RUN876
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-853c0ffa-22_2
pdb
3.8
± 0.3
RUN779
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-b4d6b7fc-7_1
pdb
3.8
± 0.3
RUN691
map
VLA-UCB-50c39ae8-2_1
pdb
ALP-POS-ecbed2ba-12_1
pdb
3.8
± 0.3
RUN879
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-853c0ffa-20_2
pdb
3.8
± 0.5
RUN651
map
VLA-UCB-50c39ae8-2_1
pdb
ALP-POS-afe0272e-2_1
pdb
3.8
± 0.2
RUN928
map
VLA-UCB-50c39ae8-2_1
pdb
LUO-POS-8484f2d3-1_2
pdb
3.8
± 0.9
RUN850
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-50a80394-2_1
pdb
3.9
± 0.4
RUN854
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-50a80394-8_2
pdb
3.9
± 0.5
RUN944
map
VLA-UCB-50c39ae8-2_1
pdb
EDJ-MED-ee81482e-3_4
pdb
3.9
± 0.7
RUN833
map
VLA-UCB-50c39ae8-2_1
pdb
EDJ-MED-5cd3920d-5_2
pdb
3.9
± 0.4
RUN687
map
VLA-UCB-50c39ae8-2_1
pdb
ALP-POS-ecbed2ba-3_2
pdb
3.9
± 0.4
RUN616
map
VLA-UCB-50c39ae8-2_1
pdb
LUO-POS-b4dec3be-1_2
pdb
3.9
± 0.2
RUN891
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-853c0ffa-12_2
pdb
4.0
± 0.4
RUN794
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-853c0ffa-14_1
pdb
4.0
± 0.4
RUN858
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-50a80394-8_1
pdb
4.0
± 0.6
RUN921
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-853c0ffa-10_1
pdb
4.0
± 0.4
RUN719
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-853c0ffa-17_1
pdb
4.0
± 0.3
RUN606
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-50a80394-4_3
pdb
4.0
± 0.2
RUN736
map
VLA-UCB-50c39ae8-2_1
pdb
ALP-POS-ecbed2ba-16_2
pdb
4.1
± 0.4
RUN568
map
VLA-UCB-50c39ae8-2_1
pdb
LUO-POS-868e8996-11_1
pdb
4.1
± 0.3
RUN522
map
VLA-UCB-50c39ae8-2_1
pdb
EDJ-MED-d4864bdc-3_1
pdb
4.1
± 0.2
RUN791
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-853c0ffa-13_1
pdb
4.1
± 0.3
RUN871
map
VLA-UCB-50c39ae8-2_1
pdb
PET-UNK-94036022-13_1
pdb
4.2
± 0.4
RUN738
map
VLA-UCB-50c39ae8-2_1
pdb
ALP-POS-ecbed2ba-10_1
pdb
4.2
± 0.5
RUN788
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-853c0ffa-7_1
pdb
4.2
± 0.6
RUN588
map
VLA-UCB-50c39ae8-2_1
pdb
EDJ-MED-94fddcec-5_1
pdb
4.2
± 0.2
RUN801
map
VLA-UCB-50c39ae8-2_1
pdb
ALP-POS-ecbed2ba-5_2
pdb
4.2
± 0.8
RUN720
map
VLA-UCB-50c39ae8-2_1
pdb
EDJ-MED-8bb691af-6_1
pdb
4.2
± 0.3
RUN711
map
VLA-UCB-50c39ae8-2_1
pdb
PET-UNK-94036022-3_2
pdb
4.2
± 0.4
RUN947
map
VLA-UCB-50c39ae8-2_1
pdb
EDJ-MED-ee81482e-5_2
pdb
4.2
± 0.5
RUN857
map
VLA-UCB-50c39ae8-2_1
pdb
EDJ-MED-5cd3920d-6_2
pdb
4.2
± 0.4
RUN918
map
VLA-UCB-50c39ae8-2_1
pdb
EDJ-MED-9f4ac58c-3_1
pdb
4.3
± 0.5
RUN787
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-853c0ffa-5_2
pdb
4.3
± 0.7
RUN800
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-853c0ffa-18_1
pdb
4.3
± 0.3
RUN547
map
VLA-UCB-50c39ae8-2_1
pdb
PET-UNK-aa57768f-2_1
pdb
4.3
± 0.1
RUN870
map
VLA-UCB-50c39ae8-2_1
pdb
EDJ-MED-b6c6ee2b-1_1
pdb
4.3
± 0.4
RUN842
map
VLA-UCB-50c39ae8-2_1
pdb
ALP-POS-ecbed2ba-1_1
pdb
4.3
± 0.5
RUN906
map
VLA-UCB-50c39ae8-2_1
pdb
ALP-POS-ecbed2ba-2_1
pdb
4.4
± 0.4
RUN764
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-38eb6498-5_2
pdb
4.4
± 0.3
RUN696
map
VLA-UCB-50c39ae8-2_1
pdb
ALP-POS-ecbed2ba-19_1
pdb
4.4
± 0.4
RUN752
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-38eb6498-5_1
pdb
4.4
± 0.3
RUN558
map
VLA-UCB-50c39ae8-2_1
pdb
EDJ-MED-8bb691af-4_1
pdb
4.4
± 0.3
RUN659
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-50a80394-5_1
pdb
4.4
± 0.3
RUN727
map
VLA-UCB-50c39ae8-2_1
pdb
ALP-POS-ecbed2ba-4_2
pdb
4.4
± 0.6
RUN598
map
VLA-UCB-50c39ae8-2_1
pdb
ALP-POS-afe0272e-1_2
pdb
4.5
± 0.3
RUN704
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-69786b79-3_2
pdb
4.5
± 0.4
RUN690
map
VLA-UCB-50c39ae8-2_1
pdb
ALP-POS-ecbed2ba-12_2
pdb
4.5
± 0.2
RUN612
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-96396902-1_2
pdb
4.5
± 0.2
RUN710
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-50a80394-6_3
pdb
4.5
± 0.3
RUN964
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-40ad851a-1_7
pdb
4.5
± 0.8
RUN803
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-1d5ab790-1_1
pdb
4.5
± 0.5
RUN898
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-38eb6498-2_2
pdb
4.5
± 0.5
RUN682
map
VLA-UCB-50c39ae8-2_1
pdb
EDJ-MED-94fddcec-6_2
pdb
4.5
± 0.2
RUN890
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-853c0ffa-15_2
pdb
4.5
± 0.6
RUN604
map
VLA-UCB-50c39ae8-2_1
pdb
PET-UNK-7e9559de-1_2
pdb
4.6
± 0.2
RUN644
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-69786b79-1_1
pdb
4.6
± 0.2
RUN935
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-40ad851a-2_1
pdb
4.6
± 0.5
RUN790
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-853c0ffa-13_2
pdb
4.6
± 0.5
RUN561
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-c7726e07-5_2
pdb
4.6
± 0.3
RUN628
map
VLA-UCB-50c39ae8-2_1
pdb
ALP-POS-ecbed2ba-14_2
pdb
4.6
± 0.2
RUN650
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-576f7758-1_1
pdb
4.6
± 0.2
RUN540
map
VLA-UCB-50c39ae8-2_1
pdb
EDJ-MED-d7486dd1-1_1
pdb
4.6
± 0.1
RUN863
map
VLA-UCB-50c39ae8-2_1
pdb
EDJ-MED-7e491f08-1_2
pdb
4.6
± 0.6
RUN750
map
VLA-UCB-50c39ae8-2_1
pdb
ALP-POS-ecbed2ba-21_2
pdb
4.7
± 0.3
RUN615
map
VLA-UCB-50c39ae8-2_1
pdb
LUO-POS-b4dec3be-2_2
pdb
4.7
± 0.3
RUN586
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-b4d6b7fc-5_1
pdb
4.7
± 0.3
RUN590
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-b4d6b7fc-5_2
pdb
4.7
± 0.2
RUN594
map
VLA-UCB-50c39ae8-2_1
pdb
ALP-POS-afe0272e-1_1
pdb
4.7
± 0.3
RUN910
map
VLA-UCB-50c39ae8-2_1
pdb
EDJ-MED-5cd3920d-1_1
pdb
4.7
± 0.4
RUN693
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-69786b79-3_1
pdb
4.7
± 0.3
RUN543
map
VLA-UCB-50c39ae8-2_1
pdb
EDJ-MED-d7486dd1-1_2
pdb
4.7
± 0.1
RUN503
map
VLA-UCB-50c39ae8-2_1
pdb
EDJ-MED-a6bab6fb-1_1
pdb
4.81
± 0.09
RUN937
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-40ad851a-2_3
pdb
4.8
± 0.6
Last updated 2022-01-08T08:55:12.869022+00:00
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