COVID Moonshot Sprint 12
Summary
Compounds
Microstates
Transformations
(current)
Reliable Transformations
Retrospective Transformations
Retrospective Compounds
Transformations
Showing 401 through 500 of 100
RUN
Atom map
Initial microstate
Final microstate
ΔΔG / kcal M
-1
Work distribution
Bootstrapping
Convergence
RUN402
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-40e596c8-3_1
pdb
−1.9
± 0.6
RUN675
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-e75f6e44-11_1
pdb
−1.9
± 0.4
RUN273
map
MAT-POS-c7726e07-5_1
pdb
LUO-POS-e1dab717-18_2
pdb
−1.9
± 0.3
RUN800
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-e75f6e44-7_1
pdb
−1.9
± 0.6
RUN580
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-7d88f880-1_1
pdb
−1.9
± 0.4
RUN562
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-9f4ac58c-6_1
pdb
−1.9
± 0.6
RUN177
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-94fddcec-7_1
pdb
−1.9
± 0.5
RUN186
map
MAT-POS-c7726e07-5_1
pdb
ALP-POS-ecbed2ba-18_1
pdb
−1.9
± 0.9
RUN1004
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-1a788f51-3_1
pdb
−1.9
± 0.8
RUN790
map
MAT-POS-c7726e07-5_1
pdb
MIK-ENA-60569a44-1_1
pdb
−1.9
± 0.8
RUN862
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-b6c6ee2b-5_1
pdb
−1.9
± 0.6
RUN329
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-d4864bdc-4_1
pdb
−1.9
± 0.6
RUN691
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-e75f6e44-17_1
pdb
−1.9
± 0.6
RUN672
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-e75f6e44-11_1
pdb
−1.9
± 0.4
RUN683
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-e75f6e44-15_1
pdb
−1.9
± 0.4
RUN187
map
MAT-POS-c7726e07-5_1
pdb
ALP-POS-ecbed2ba-14_1
pdb
−1.9
± 0.4
RUN178
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-853c0ffa-1_1
pdb
−1.9
± 0.3
RUN698
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-e75f6e44-18_1
pdb
−1.9
± 0.4
RUN350
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-566864e2-1_1
pdb
−1.8
± 0.3
RUN323
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-50a80394-6_1
pdb
−1.8
± 0.3
RUN74
map
MAT-POS-c7726e07-5_1
pdb
VLA-UNK-3bd6fc51-1_2
pdb
−1.8
± 0.3
RUN716
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-33064c06-16_2
pdb
−1.8
± 0.6
RUN170
map
MAT-POS-c7726e07-5_1
pdb
EDG-MED-b1ef7fe3-2_1
pdb
−1.8
± 0.4
RUN504
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-6b23330e-6_1
pdb
−1.8
± 0.5
RUN634
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-6b23330e-3_2
pdb
−1.8
± 0.4
RUN668
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-e75f6e44-10_1
pdb
−1.8
± 0.4
RUN268
map
MAT-POS-c7726e07-5_1
pdb
LUO-POS-e1dab717-1_2
pdb
−1.8
± 0.3
RUN630
map
MAT-POS-c7726e07-5_1
pdb
ALP-POS-c3a90b22-10_1
pdb
−1.8
± 0.3
RUN500
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-6b23330e-5_2
pdb
−1.8
± 0.2
RUN1052
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-40ad851a-5_1
pdb
−1.8
± 0.9
RUN793
map
MAT-POS-c7726e07-5_1
pdb
MIK-ENA-bb7b6957-1_1
pdb
−1.8
± 0.9
RUN870
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-4138fde9-3_2
pdb
−1.7
± 0.5
RUN587
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-a12e3a20-1_1
pdb
−1.7
± 0.8
RUN636
map
MAT-POS-c7726e07-5_1
pdb
ALP-POS-c3a90b22-10_1
pdb
−1.7
± 0.4
RUN707
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-33064c06-9_1
pdb
−1.7
± 0.2
RUN1071
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-dfa1d800-3_1
pdb
−1.7
± 0.7
RUN654
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-e75f6e44-6_2
pdb
−1.7
± 0.7
RUN502
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-6b23330e-6_1
pdb
−1.7
± 0.5
RUN195
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-69786b79-1_2
pdb
−1.6
± 0.3
RUN847
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-38eb6498-4_1
pdb
−1.6
± 0.5
RUN259
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-566864e2-3_2
pdb
−1.6
± 0.3
RUN875
map
MAT-POS-c7726e07-5_1
pdb
MIK-ENA-be04d1d4-1_1
pdb
−1.6
± 0.7
RUN1081
map
MAT-POS-c7726e07-5_1
pdb
MIC-UNK-c85ea37c-2_1
pdb
−1.6
± 1.0
RUN670
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-e75f6e44-10_2
pdb
−1.6
± 0.5
RUN398
map
MAT-POS-c7726e07-5_1
pdb
ALP-POS-c3a90b22-4_2
pdb
−1.6
± 0.4
RUN682
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-e75f6e44-15_2
pdb
−1.6
± 0.4
RUN470
map
MAT-POS-c7726e07-5_1
pdb
LUO-POS-e1dab717-4_1
pdb
−1.6
± 0.3
RUN438
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-38eb6498-5_1
pdb
−1.58
± 0.08
RUN602
map
MAT-POS-c7726e07-5_1
pdb
LUO-POS-ed2cfb03-1_1
pdb
−1.6
± 1.0
RUN262
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-566864e2-4_2
pdb
−1.6
± 0.3
RUN801
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-e75f6e44-20_1
pdb
−1.6
± 0.5
RUN230
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-b6c6ee2b-6_1
pdb
−1.6
± 0.3
RUN442
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-38eb6498-5_1
pdb
−1.56
± 0.07
RUN455
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-be048f2c-5_1
pdb
−1.6
± 0.3
RUN510
map
MAT-POS-c7726e07-5_1
pdb
ALP-POS-c3a90b22-1_1
pdb
−1.6
± 0.7
RUN788
map
MAT-POS-c7726e07-5_1
pdb
ALP-POS-c3a90b22-8_1
pdb
−1.5
± 0.4
RUN136
map
MAT-POS-c7726e07-5_1
pdb
JOH-MSK-1f2dff76-2_2
pdb
−1.5
± 0.3
RUN585
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-98c0a822-2_1
pdb
−1.5
± 0.6
RUN252
map
MAT-POS-c7726e07-5_1
pdb
PET-UNK-77d5678a-4_1
pdb
−1.5
± 0.2
RUN247
map
MAT-POS-c7726e07-5_1
pdb
PET-UNK-77d5678a-3_1
pdb
−1.5
± 0.3
RUN249
map
MAT-POS-c7726e07-5_1
pdb
PET-UNK-77d5678a-4_1
pdb
−1.5
± 0.2
RUN409
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-8bb691af-6_1
pdb
−1.5
± 0.8
RUN841
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-853c0ffa-20_1
pdb
−1.5
± 0.9
RUN207
map
MAT-POS-c7726e07-5_1
pdb
ALP-POS-afe0272e-2_1
pdb
−1.5
± 0.4
RUN855
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-5cd3920d-3_1
pdb
−1.5
± 0.4
RUN327
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-50a80394-6_4
pdb
−1.5
± 0.3
RUN453
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-be048f2c-5_1
pdb
−1.5
± 0.2
RUN574
map
MAT-POS-c7726e07-5_1
pdb
ALP-POS-ecbed2ba-8_1
pdb
−1.5
± 1.0
RUN561
map
MAT-POS-c7726e07-5_1
pdb
LUO-POS-868e8996-9_1
pdb
−1.5
± 0.8
RUN549
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-33064c06-13_1
pdb
−1.5
± 0.3
RUN105
map
MAT-POS-c7726e07-5_1
pdb
PET-UNK-7e9559de-4_1
pdb
−1.5
± 0.4
RUN222
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-50a80394-7_2
pdb
−1.5
± 0.3
RUN21
map
MAT-POS-c7726e07-5_1
pdb
ALP-POS-4483ae88-1_1
pdb
−1.5
± 0.7
RUN232
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-ede5c6cb-1_1
pdb
−1.5
± 0.6
RUN695
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-e75f6e44-18_2
pdb
−1.5
± 0.5
RUN204
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-576f7758-1_2
pdb
−1.5
± 0.3
RUN240
map
MAT-POS-c7726e07-5_1
pdb
PET-UNK-94036022-14_2
pdb
−1.4
± 0.3
RUN758
map
MAT-POS-c7726e07-5_1
pdb
VLA-UNK-61877630-10_1
pdb
−1.4
± 0.8
RUN708
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-33064c06-9_1
pdb
−1.4
± 0.2
RUN523
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-e75f6e44-1_2
pdb
−1.4
± 0.5
RUN210
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-a12e3a20-2_1
pdb
−1.4
± 0.4
RUN851
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-50a80394-3_2
pdb
−1.4
± 0.9
RUN856
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-5cd3920d-3_1
pdb
−1.4
± 0.5
RUN103
map
MAT-POS-c7726e07-5_1
pdb
PET-UNK-7e9559de-4_1
pdb
−1.4
± 0.3
RUN444
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-38eb6498-5_1
pdb
−1.40
± 0.10
RUN536
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-e75f6e44-4_1
pdb
−1.4
± 0.6
RUN625
map
MAT-POS-c7726e07-5_1
pdb
VLA-UNK-8e615992-4_2
pdb
−1.4
± 0.4
RUN468
map
MAT-POS-c7726e07-5_1
pdb
VLA-UNK-61877630-6_2
pdb
−1.4
± 0.4
RUN231
map
MAT-POS-c7726e07-5_1
pdb
PET-UNK-94036022-7_1
pdb
−1.3
± 0.4
RUN112
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-50a80394-4_4
pdb
−1.3
± 0.4
RUN319
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-cc48ee33-3_1
pdb
−1.3
± 0.3
RUN604
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-7e491f08-2_1
pdb
−1.3
± 0.4
RUN96
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-1d5ab790-2_1
pdb
−1.3
± 0.2
RUN718
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-9f4ac58c-5_1
pdb
−1.3
± 0.8
RUN99
map
MAT-POS-c7726e07-5_1
pdb
PET-UNK-7e9559de-1_1
pdb
−1.3
± 0.3
RUN246
map
MAT-POS-c7726e07-5_1
pdb
PET-UNK-77d5678a-1_1
pdb
−1.3
± 0.3
RUN799
map
MAT-POS-c7726e07-5_1
pdb
MAT-POS-e75f6e44-7_2
pdb
−1.3
± 0.6
RUN314
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-976a33d5-1_1
pdb
−1.3
± 0.3
RUN173
map
MAT-POS-c7726e07-5_1
pdb
EDJ-MED-94fddcec-7_1
pdb
−1.3
± 0.5
RUN63
map
MAT-POS-c7726e07-5_1
pdb
LUO-POS-868e8996-12_2
pdb
−1.3
± 0.3
Last updated 2022-02-18T20:16:45.438838+00:00
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