COVID Moonshot Sprint 11
Summary
Compounds
Microstates
Transformations
Reliable Transformations
(current)
Retrospective Transformations
Retrospective Compounds
Reliable Transformations
Showing 101 through 200 of 100
RUN
Atom map
Initial microstate
Final microstate
ΔΔG / kcal M
-1
Work distribution
Bootstrapping
Convergence
RUN117
map
VLA-UCB-50c39ae8-2_1
pdb
PET-UNK-77d5678a-6_1
pdb
−0.31
± 0.07
RUN311
map
VLA-UCB-50c39ae8-2_1
pdb
LUO-POS-8484f2d3-2_1
pdb
−0.3
± 0.5
RUN115
map
VLA-UCB-50c39ae8-2_1
pdb
LUO-POS-8c3e556a-1_1
pdb
−0.27
± 0.10
RUN169
map
VLA-UCB-50c39ae8-2_1
pdb
VLA-UNK-f702bf1c-7_1
pdb
−0.3
± 0.2
RUN247
map
VLA-UCB-50c39ae8-2_1
pdb
VLA-UNK-61877630-3_1
pdb
−0.3
± 0.1
RUN32
map
VLA-UCB-50c39ae8-2_1
pdb
PET-UNK-aa57768f-9_1
pdb
−0.26
± 0.09
RUN50
map
VLA-UCB-50c39ae8-2_1
pdb
EDJ-MED-8bb691af-8_1
pdb
−0.21
± 0.10
RUN334
map
VLA-UCB-50c39ae8-2_1
pdb
EDJ-MED-ee81482e-5_1
pdb
−0.2
± 0.4
RUN52
map
VLA-UCB-50c39ae8-2_1
pdb
PET-UNK-14142a25-1_1
pdb
−0.18
± 0.10
RUN178
map
VLA-UCB-50c39ae8-2_1
pdb
ALP-POS-ecbed2ba-9_1
pdb
−0.2
± 0.3
RUN240
map
VLA-UCB-50c39ae8-2_1
pdb
JOH-MSK-b735e33c-1_2
pdb
−0.1
± 0.2
RUN85
map
VLA-UCB-50c39ae8-2_1
pdb
EDG-MED-b1ef7fe3-1_1
pdb
−0.1
± 0.1
RUN68
map
VLA-UCB-50c39ae8-2_1
pdb
LUO-POS-9931618f-1_1
pdb
−0.14
± 0.10
RUN250
map
VLA-UCB-50c39ae8-2_1
pdb
EDJ-MED-5cd3920d-4_1
pdb
−0.1
± 0.1
RUN101
map
VLA-UCB-50c39ae8-2_1
pdb
PET-UNK-aa57768f-1_1
pdb
−0.1
± 0.1
RUN217
map
VLA-UCB-50c39ae8-2_1
pdb
PET-UNK-94036022-5_1
pdb
−0.1
± 0.2
RUN144
map
VLA-UCB-50c39ae8-2_1
pdb
EDJ-MED-fed7ac0b-2_1
pdb
−0.1
± 0.1
RUN202
map
VLA-UCB-50c39ae8-2_1
pdb
PET-UNK-94036022-12_1
pdb
−0.1
± 0.2
RUN326
map
VLA-UCB-50c39ae8-2_1
pdb
EDJ-MED-468565e0-1_1
pdb
−0.1
± 0.5
RUN267
map
VLA-UCB-50c39ae8-2_1
pdb
EDJ-MED-7e491f08-1_1
pdb
−0.1
± 0.4
RUN277
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-853c0ffa-22_1
pdb
−0.1
± 0.2
RUN154
map
VLA-UCB-50c39ae8-2_1
pdb
PET-UNK-77d5678a-5_1
pdb
−0.07
± 0.07
RUN81
map
VLA-UCB-50c39ae8-2_1
pdb
MIK-ENA-794411b8-1_1
pdb
−0.07
± 0.10
RUN136
map
VLA-UCB-50c39ae8-2_1
pdb
EDJ-MED-976a33d5-1_1
pdb
−0.1
± 0.1
RUN93
map
VLA-UCB-50c39ae8-2_1
pdb
EDG-MED-b1ef7fe3-3_1
pdb
−0.04
± 0.09
RUN2
map
VLA-UCB-50c39ae8-2_1
pdb
EDJ-MED-159244ea-1_1
pdb
−0.03
± 0.04
RUN106
map
VLA-UCB-50c39ae8-2_1
pdb
ALP-POS-ecbed2ba-18_1
pdb
−0.0
± 0.2
RUN88
map
VLA-UCB-50c39ae8-2_1
pdb
EDG-MED-b1ef7fe3-2_1
pdb
−0.0
± 0.1
RUN191
map
VLA-UCB-50c39ae8-2_1
pdb
EDJ-MED-b6c6ee2b-7_1
pdb
−0.00
± 0.10
RUN21
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-94643566-1_1
pdb
−0.001
± 0.004
RUN23
map
VLA-UCB-50c39ae8-2_1
pdb
VLA-UCB-05e51b3f-5_1
pdb
−0.001
± 0.003
RUN13
map
VLA-UCB-50c39ae8-2_1
pdb
VLA-UCB-50c39ae8-2_1
pdb
0.001
± 0.005
RUN16
map
VLA-UCB-50c39ae8-2_1
pdb
BEN-BAS-c2bc0d80-6_1
pdb
0.001
± 0.004
RUN206
map
VLA-UCB-50c39ae8-2_1
pdb
LUO-POS-868e8996-10_1
pdb
0.0
± 0.3
RUN105
map
VLA-UCB-50c39ae8-2_1
pdb
EDJ-MED-b6c6ee2b-6_1
pdb
0.01
± 0.09
RUN104
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-50a80394-4_2
pdb
0.0
± 0.2
RUN87
map
VLA-UCB-50c39ae8-2_1
pdb
VLA-UNK-f702bf1c-3_1
pdb
0.0
± 0.1
RUN78
map
VLA-UCB-50c39ae8-2_1
pdb
MIK-ENA-37e0b697-1_1
pdb
0.0
± 0.1
RUN142
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-576f7758-2_1
pdb
0.0
± 0.1
RUN271
map
VLA-UCB-50c39ae8-2_1
pdb
EDJ-MED-7d88f880-2_2
pdb
0.0
± 0.1
RUN155
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-e48723dc-2_1
pdb
0.05
± 0.10
RUN224
map
VLA-UCB-50c39ae8-2_1
pdb
EDJ-MED-7d88f880-1_2
pdb
0.1
± 0.1
RUN92
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-853c0ffa-1_1
pdb
0.08
± 0.09
RUN166
map
VLA-UCB-50c39ae8-2_1
pdb
PET-UNK-94036022-10_1
pdb
0.1
± 0.2
RUN15
map
VLA-UCB-50c39ae8-2_1
pdb
ALP-POS-477dc5b7-4_1
pdb
0.09
± 0.04
RUN133
map
VLA-UCB-50c39ae8-2_1
pdb
ALP-POS-ecbed2ba-3_1
pdb
0.1
± 0.2
RUN284
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-50a80394-3_1
pdb
0.1
± 0.4
RUN37
map
VLA-UCB-50c39ae8-2_1
pdb
PET-UNK-aa57768f-3_1
pdb
0.10
± 0.08
RUN90
map
VLA-UCB-50c39ae8-2_1
pdb
LUO-POS-868e8996-7_1
pdb
0.13
± 0.09
RUN293
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-853c0ffa-11_1
pdb
0.1
± 0.3
RUN72
map
VLA-UCB-50c39ae8-2_1
pdb
LUO-POS-9931618f-2_1
pdb
0.2
± 0.1
RUN201
map
VLA-UCB-50c39ae8-2_1
pdb
EDJ-MED-cc48ee33-4_1
pdb
0.2
± 0.1
RUN91
map
VLA-UCB-50c39ae8-2_1
pdb
EDG-MED-b1ef7fe3-4_1
pdb
0.2
± 0.1
RUN11
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-983b399a-1_1
pdb
0.18
± 0.05
RUN119
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-1d5ab790-3_1
pdb
0.19
± 0.10
RUN309
map
VLA-UCB-50c39ae8-2_1
pdb
EDJ-MED-5cd3920d-1_1
pdb
0.2
± 0.3
RUN329
map
VLA-UCB-50c39ae8-2_1
pdb
EDJ-MED-468565e0-5_1
pdb
0.2
± 0.5
RUN36
map
VLA-UCB-50c39ae8-2_1
pdb
DAR-DIA-0f7b7cd9-8_1
pdb
0.21
± 0.05
RUN148
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-50a80394-5_2
pdb
0.2
± 0.2
RUN28
map
VLA-UCB-50c39ae8-2_1
pdb
VLA-UNK-56836b69-2_1
pdb
0.23
± 0.08
RUN210
map
VLA-UCB-50c39ae8-2_1
pdb
PET-UNK-94036022-2_1
pdb
0.2
± 0.2
RUN320
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-40ad851a-1_2
pdb
0.2
± 0.7
RUN244
map
VLA-UCB-50c39ae8-2_1
pdb
EDJ-MED-98c0a822-2_1
pdb
0.3
± 0.3
RUN122
map
VLA-UCB-50c39ae8-2_1
pdb
EDJ-MED-a12e3a20-2_1
pdb
0.27
± 0.10
RUN261
map
VLA-UCB-50c39ae8-2_1
pdb
VLA-UNK-61877630-10_1
pdb
0.3
± 0.3
RUN251
map
VLA-UCB-50c39ae8-2_1
pdb
ALP-POS-ecbed2ba-22_1
pdb
0.3
± 0.3
RUN256
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-50a80394-2_1
pdb
0.3
± 0.3
RUN223
map
VLA-UCB-50c39ae8-2_1
pdb
EDJ-MED-7d88f880-1_1
pdb
0.3
± 0.1
RUN239
map
VLA-UCB-50c39ae8-2_1
pdb
EDJ-MED-b6c6ee2b-4_1
pdb
0.3
± 0.3
RUN10
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-90505e2b-1_1
pdb
0.31
± 0.02
RUN265
map
VLA-UCB-50c39ae8-2_1
pdb
VLA-UNK-61877630-8_1
pdb
0.3
± 0.3
RUN18
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-ec6d90b7-1_1
pdb
0.34
± 0.03
RUN175
map
VLA-UCB-50c39ae8-2_1
pdb
ALP-POS-ecbed2ba-13_1
pdb
0.3
± 0.3
RUN188
map
VLA-UCB-50c39ae8-2_1
pdb
EDJ-MED-98c0a822-4_1
pdb
0.4
± 0.1
RUN215
map
VLA-UCB-50c39ae8-2_1
pdb
LUO-POS-868e8996-9_1
pdb
0.4
± 0.3
RUN235
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-50a80394-1_1
pdb
0.4
± 0.3
RUN30
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-ec6d90b7-2_1
pdb
0.39
± 0.03
RUN266
map
VLA-UCB-50c39ae8-2_1
pdb
EDJ-MED-976a33d5-2_1
pdb
0.4
± 0.1
RUN316
map
VLA-UCB-50c39ae8-2_1
pdb
EDJ-MED-ee81482e-2_1
pdb
0.4
± 0.5
RUN26
map
VLA-UCB-50c39ae8-2_1
pdb
VLA-UNK-3a43cd95-1_1
pdb
0.41
± 0.06
RUN197
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-1bed62cf-1_1
pdb
0.4
± 0.3
RUN221
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-853c0ffa-13_1
pdb
0.4
± 0.3
RUN64
map
VLA-UCB-50c39ae8-2_1
pdb
EDJ-MED-fed7ac0b-1_1
pdb
0.5
± 0.1
RUN172
map
VLA-UCB-50c39ae8-2_1
pdb
PET-UNK-94036022-3_1
pdb
0.5
± 0.2
RUN167
map
VLA-UCB-50c39ae8-2_1
pdb
EDJ-MED-8bb691af-6_1
pdb
0.5
± 0.3
RUN339
map
VLA-UCB-50c39ae8-2_1
pdb
EDJ-MED-468565e0-3_1
pdb
0.5
± 0.5
RUN252
map
VLA-UCB-50c39ae8-2_1
pdb
EDJ-MED-5cd3920d-5_1
pdb
0.5
± 0.3
RUN12
map
VLA-UCB-50c39ae8-2_1
pdb
DAR-DIA-6be260fc-5_1
pdb
0.51
± 0.07
RUN27
map
VLA-UCB-50c39ae8-2_1
pdb
DAR-DIA-0f7b7cd9-9_1
pdb
0.53
± 0.05
RUN237
map
VLA-UCB-50c39ae8-2_1
pdb
VLA-UNK-61877630-7_1
pdb
0.5
± 0.3
RUN195
map
VLA-UCB-50c39ae8-2_1
pdb
MIK-ENA-5d9157e9-1_1
pdb
0.5
± 0.4
RUN127
map
VLA-UCB-50c39ae8-2_1
pdb
VLA-UCB-34f3ed0c-15_1
pdb
0.5
± 0.3
RUN73
map
VLA-UCB-50c39ae8-2_1
pdb
EDJ-MED-fd8ed875-3_1
pdb
0.56
± 0.09
RUN182
map
VLA-UCB-50c39ae8-2_1
pdb
ALP-POS-ecbed2ba-10_1
pdb
0.6
± 0.3
RUN130
map
VLA-UCB-50c39ae8-2_1
pdb
EDJ-MED-fd8ed875-5_1
pdb
0.58
± 0.09
RUN214
map
VLA-UCB-50c39ae8-2_1
pdb
EDJ-MED-cc48ee33-2_1
pdb
0.6
± 0.1
RUN233
map
VLA-UCB-50c39ae8-2_1
pdb
EDJ-MED-a12e3a20-1_1
pdb
0.6
± 0.4
RUN292
map
VLA-UCB-50c39ae8-2_1
pdb
MAT-POS-853c0ffa-16_1
pdb
0.6
± 0.2
RUN79
map
VLA-UCB-50c39ae8-2_1
pdb
JOH-MSK-1f2dff76-2_1
pdb
0.6
± 0.2
RUN45
map
VLA-UCB-50c39ae8-2_1
pdb
EDJ-MED-7587a9ee-3_1
pdb
0.6
± 0.1
Last updated 2022-01-14T16:24:15.053114+00:00
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