COVID Moonshot Sprint 12
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
RUN766
map
MAT-POS-c7726e07-5_1
pdb
LUO-POS-e1dab717-9_2
pdb
−2.5
± 0.4
RUN302
map
MAT-POS-c7726e07-5_1
pdb
ALP-POS-ecbed2ba-12_1
pdb
−2.5
± 0.4
RUN199
map
MAT-POS-c7726e07-5_1
pdb
PET-UNK-aa57768f-7_1
pdb
−2.5
± 0.2
RUN62
map
MAT-POS-c7726e07-5_1
pdb
LUO-POS-868e8996-12_1
pdb
−2.5
± 0.5
RUN661
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-e75f6e44-8_3
pdb
−2.5
± 0.6
RUN810
map
MAT-POS-c7726e07-5_1
pdb
MIK-ENA-99706bb8-1_2
pdb
−2.5
± 0.8
RUN541
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-e75f6e44-13_1
pdb
−2.5
± 0.5
RUN2
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-983b399a-1_1
pdb
−2.5
± 0.3
RUN688
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-e75f6e44-17_1
pdb
−2.5
± 0.6
RUN599
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-5cd3920d-5_1
pdb
−2.4
± 0.8
RUN1030
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-40ad851a-1_1
pdb
−2
± 1
RUN351
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-566864e2-1_1
pdb
−2.4
± 0.5
RUN309
map
MAT-POS-c7726e07-5_1
pdb
ALP-POS-ecbed2ba-19_1
pdb
−2.4
± 1.0
RUN347
map
MAT-POS-c7726e07-5_1
pdb
PET-UNK-77d5678a-5_1
pdb
−2.4
± 0.3
RUN102
map
MAT-POS-c7726e07-5_1
pdb
PET-UNK-7e9559de-1_1
pdb
−2.4
± 0.3
RUN326
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-50a80394-6_1
pdb
−2.4
± 0.3
RUN715
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-9f4ac58c-1_1
pdb
−2.4
± 0.4
RUN430
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-69786b79-4_1
pdb
−2.4
± 0.5
RUN507
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-6b23330e-7_2
pdb
−2.4
± 0.4
RUN744
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-7e491f08-1_1
pdb
−2.4
± 0.9
RUN117
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-96396902-1_1
pdb
−2.4
± 0.3
RUN1036
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-40ad851a-1_3
pdb
−2.4
± 0.9
RUN355
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-566864e2-1_1
pdb
−2.4
± 0.4
RUN330
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-50a80394-6_2
pdb
−2.4
± 0.4
RUN106
map
MAT-POS-c7726e07-5_1
pdb
PET-UNK-7e9559de-4_1
pdb
−2.4
± 0.3
RUN484
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-4138fde9-9_1
pdb
−2.4
± 0.8
RUN617
map
MAT-POS-c7726e07-5_1
pdb
LUO-POS-e1dab717-12_1
pdb
−2.4
± 0.6
RUN848
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-38eb6498-4_1
pdb
−2.4
± 0.5
RUN208
map
MAT-POS-c7726e07-5_1
pdb
ALP-POS-afe0272e-2_1
pdb
−2.4
± 0.5
RUN78
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-1bed62cf-3_2
pdb
−2.4
± 0.3
RUN229
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-b6c6ee2b-2_2
pdb
−2.4
± 0.3
RUN774
map
MAT-POS-c7726e07-5_1
pdb
PET-UNK-c6bcc80b-5_1
pdb
−2.4
± 0.2
RUN306
map
MAT-POS-c7726e07-5_1
pdb
ALP-POS-ecbed2ba-12_2
pdb
−2.4
± 0.3
RUN441
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-98c0a822-3_1
pdb
−2.4
± 0.5
RUN550
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-e75f6e44-14_1
pdb
−2.3
± 0.5
RUN64
map
MAT-POS-c7726e07-5_1
pdb
LUO-POS-868e8996-11_2
pdb
−2.3
± 0.3
RUN540
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-e75f6e44-13_1
pdb
−2.3
± 0.4
RUN101
map
MAT-POS-c7726e07-5_1
pdb
PET-UNK-7e9559de-1_1
pdb
−2.3
± 0.4
RUN251
map
MAT-POS-c7726e07-5_1
pdb
PET-UNK-77d5678a-6_1
pdb
−2.3
± 0.2
RUN55
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-c7726e07-6_2
pdb
−2.3
± 0.3
RUN108
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-50a80394-4_3
pdb
−2.3
± 0.3
RUN740
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-5cd3920d-4_1
pdb
−2.3
± 0.3
RUN315
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-69786b79-3_2
pdb
−2.3
± 0.3
RUN652
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-e75f6e44-8_1
pdb
−2.3
± 0.5
RUN534
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-e75f6e44-4_2
pdb
−2.3
± 0.2
RUN702
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-33064c06-1_1
pdb
−2.3
± 0.4
RUN345
map
MAT-POS-c7726e07-5_1
pdb
PET-UNK-77d5678a-2_1
pdb
−2.3
± 0.3
RUN818
map
MAT-POS-c7726e07-5_1
pdb
MIK-ENA-623fe2a6-1_1
pdb
−2.3
± 0.8
RUN392
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-6b23330e-1_2
pdb
−2.2
± 0.2
RUN450
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-cc48ee33-4_1
pdb
−2.2
± 0.3
RUN548
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-e75f6e44-14_2
pdb
−2.2
± 0.4
RUN570
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-853c0ffa-18_1
pdb
−2.2
± 0.7
RUN509
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-6b23330e-7_1
pdb
−2.2
± 0.7
RUN129
map
MAT-POS-c7726e07-5_1
pdb
LUO-POS-b4dec3be-2_2
pdb
−2.2
± 0.3
RUN791
map
MAT-POS-c7726e07-5_1
pdb
MIK-ENA-60569a44-1_1
pdb
−2
± 1
RUN348
map
MAT-POS-c7726e07-5_1
pdb
12_-111-3e02a1cd-1_1
pdb
−2.2
± 0.2
RUN657
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-e75f6e44-9_1
pdb
−2.2
± 0.4
RUN98
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-1d5ab790-2_1
pdb
−2.2
± 0.3
RUN182
map
MAT-POS-c7726e07-5_1
pdb
ALP-POS-ecbed2ba-7_2
pdb
−2.2
± 0.3
RUN711
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-33064c06-12_1
pdb
−2.2
± 0.5
RUN773
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-4138fde9-7_1
pdb
−2.1
± 0.9
RUN678
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-e75f6e44-12_2
pdb
−2.1
± 0.3
RUN858
map
MAT-POS-c7726e07-5_1
pdb
LUO-POS-e1dab717-10_1
pdb
−2.1
± 0.4
RUN555
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-9f4ac58c-2_1
pdb
−2.1
± 0.5
RUN537
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-e75f6e44-5_1
pdb
−2.1
± 0.6
RUN532
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-e75f6e44-3_2
pdb
−2.1
± 0.4
RUN1062
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-468565e0-5_1
pdb
−2.1
± 1.0
RUN152
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-ddfe83c6-6_2
pdb
−2.1
± 0.2
RUN354
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-566864e2-1_2
pdb
−2.1
± 0.3
RUN116
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-96396902-1_1
pdb
−2.1
± 0.3
RUN656
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-e75f6e44-8_4
pdb
−2.1
± 0.2
RUN621
map
MAT-POS-c7726e07-5_1
pdb
VLA-UNK-e334495f-1_1
pdb
−2.1
± 0.9
RUN362
map
MAT-POS-c7726e07-5_1
pdb
LUO-POS-e1dab717-3_2
pdb
−2.1
± 0.3
RUN494
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-6b23330e-2_2
pdb
−2.1
± 0.2
RUN753
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-b6c6ee2b-3_1
pdb
−2.1
± 0.8
RUN826
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-33064c06-3_1
pdb
−2.1
± 0.6
RUN673
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-e75f6e44-11_1
pdb
−2.1
± 0.4
RUN760
map
MAT-POS-c7726e07-5_1
pdb
VLA-UNK-f2612802-1_1
pdb
−2.1
± 0.4
RUN379
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-0d144977-1_1
pdb
−2.1
± 0.3
RUN516
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-40e596c8-2_1
pdb
−2.1
± 0.7
RUN809
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-e75f6e44-21_2
pdb
−2.1
± 0.6
RUN518
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-40e596c8-2_1
pdb
−2.0
± 0.8
RUN375
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-accc2c4d-4_1
pdb
−2.0
± 0.8
RUN622
map
MAT-POS-c7726e07-5_1
pdb
VLA-UNK-8e615992-4_2
pdb
−2.0
± 0.4
RUN627
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-4cb9dd84-2_1
pdb
−2.0
± 0.2
RUN741
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-5cd3920d-4_1
pdb
−2.0
± 0.4
RUN491
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-6b23330e-2_1
pdb
−2.0
± 0.6
RUN265
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-566864e2-4_1
pdb
−2.0
± 0.6
RUN556
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-b4d6b7fc-7_2
pdb
−2.0
± 0.3
RUN723
map
MAT-POS-c7726e07-5_1
pdb
ALP-POS-ecbed2ba-1_1
pdb
−2.0
± 1.0
RUN435
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-69786b79-4_2
pdb
−2.0
± 0.5
RUN192
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-69786b79-1_1
pdb
−2.0
± 0.6
RUN659
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-e75f6e44-9_1
pdb
−2.0
± 0.5
RUN396
map
MAT-POS-c7726e07-5_1
pdb
ALP-POS-c3a90b22-2_2
pdb
−2.0
± 0.3
RUN840
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-853c0ffa-20_1
pdb
−2.0
± 0.9
RUN792
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-59d5ca70-1_1
pdb
−2.0
± 0.2
RUN460
map
MAT-POS-c7726e07-5_1
pdb
PET-UNK-94036022-2_1
pdb
−2.0
± 0.7
RUN1021
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-dfa1d800-2_1
pdb
−2.0
± 0.5
RUN565
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-853c0ffa-5_1
pdb
−1.9
± 0.8
RUN992
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-40ad851a-2_2
pdb
−1.9
± 0.9
Last updated 2022-02-18T20:16:45.438838+00:00
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