COVID Moonshot Sprint 5
Summary
Compounds
Microstates
Transformations
(current)
Reliable transformations
Retrospective transformations
Transformations
Showing 6701 through 6800 of 7687
RUN
Initial microstate
Final microstate
ΔΔG / kcal M
-1
Work distribution
Convergence
RUN5948
MAT-POS-b3e365b9-1_1
sdf
pdb
EN300-1178005_2_1_1
sdf
pdb
2.0
± 0.2
RUN1845
MAT-POS-b3e365b9-1_1
sdf
pdb
RAL-THA-2d450e86-34_1
sdf
pdb
2.0
± 0.2
RUN1399
MAT-POS-b3e365b9-1_1
sdf
pdb
DAR-DIA-9e4459de-11_10
sdf
pdb
2.0
± 0.5
RUN618
MAT-POS-b3e365b9-1_1
sdf
pdb
MAK-UNK-ffc90da7-4_6
sdf
pdb
2.0
± 0.5
RUN1926
MAT-POS-b3e365b9-1_1
sdf
pdb
RAL-THA-05e671eb-29_2
sdf
pdb
2.0
± 0.3
RUN1294
MAT-POS-b3e365b9-1_1
sdf
pdb
DAR-DIA-076fb6ea-3_1
sdf
pdb
2.0
± 0.5
RUN1984
MAT-POS-b3e365b9-1_1
sdf
pdb
KAD-UNI-8a629cb0-10_1
sdf
pdb
2.0
± 0.3
RUN604
MAT-POS-b3e365b9-1_1
sdf
pdb
MIC-UNK-5a93dd5f-1_1
sdf
pdb
2.0
± 0.4
RUN1837
MAT-POS-b3e365b9-1_1
sdf
pdb
EDJ-MED-4c7486ba-8_1
sdf
pdb
2.0
± 0.3
RUN5886
MAT-POS-b3e365b9-1_1
sdf
pdb
EN300-52380_2_1_1
sdf
pdb
2.0
± 0.2
RUN133
MAT-POS-b3e365b9-1_1
sdf
pdb
MAT-POS-bb423b95-9_1
sdf
pdb
2.0
± 0.3
RUN1116
MAT-POS-b3e365b9-1_1
sdf
pdb
BEN-DND-c852c98b-4_2
sdf
pdb
2.0
± 0.2
RUN2279
MAT-POS-b3e365b9-1_1
sdf
pdb
ALP-POS-5bb456a5-8_1
sdf
pdb
2.0
± 0.5
RUN87
MAT-POS-b3e365b9-1_1
sdf
pdb
MAT-POS-b5746674-34_1
sdf
pdb
2.0
± 0.7
RUN674
MAT-POS-b3e365b9-1_1
sdf
pdb
MAK-UNK-ffc90da7-4_3
sdf
pdb
2.0
± 0.6
RUN861
MAT-POS-b3e365b9-1_1
sdf
pdb
MAK-UNK-c749d764-10_8
sdf
pdb
2.0
± 0.3
RUN2208
MAT-POS-b3e365b9-1_1
sdf
pdb
EDJ-MED-d08626de-3_1
sdf
pdb
2.0
± 0.4
RUN797
MAT-POS-b3e365b9-1_1
sdf
pdb
DAR-DIA-0d514e7d-32_30
sdf
pdb
2.0
± 0.3
RUN1794
MAT-POS-b3e365b9-1_1
sdf
pdb
RAL-THA-2d450e86-7_1
sdf
pdb
2.0
± 0.2
RUN787
MAT-POS-b3e365b9-1_1
sdf
pdb
DAR-DIA-0d514e7d-35_1
sdf
pdb
2.0
± 0.3
RUN4437
MAT-POS-b3e365b9-1_1
sdf
pdb
EN300-23318_2_2_1
sdf
pdb
2.0
± 0.4
RUN4286
MAT-POS-b3e365b9-1_1
sdf
pdb
EN300-180532_1_2_1
sdf
pdb
2.0
± 0.4
RUN2115
MAT-POS-b3e365b9-1_1
sdf
pdb
MAT-POS-e9e99895-6_2
sdf
pdb
2.0
± 0.4
RUN1389
MAT-POS-b3e365b9-1_1
sdf
pdb
DAR-DIA-9e4459de-13_15
sdf
pdb
2.0
± 0.6
RUN1064
MAT-POS-b3e365b9-1_1
sdf
pdb
MAK-UNK-c749d764-29_1
sdf
pdb
2.0
± 0.5
RUN4166
MAT-POS-b3e365b9-1_1
sdf
pdb
EN300-746187_1_2_3
sdf
pdb
2.0
± 0.5
RUN2919
MAT-POS-b3e365b9-1_1
sdf
pdb
EN300-307008_2_1_1
sdf
pdb
2.0
± 0.3
RUN1937
MAT-POS-b3e365b9-1_1
sdf
pdb
MAT-POS-5d65ec79-1_1
sdf
pdb
2.0
± 0.3
RUN195
MAT-POS-b3e365b9-1_1
sdf
pdb
MIC-UNK-9582b2c5-1_3
sdf
pdb
2.0
± 0.3
RUN2161
MAT-POS-b3e365b9-1_1
sdf
pdb
EDJ-MED-2f867453-1_2
sdf
pdb
2.0
± 0.3
RUN2249
MAT-POS-b3e365b9-1_1
sdf
pdb
ALP-POS-2da19ca7-8_2
sdf
pdb
2.0
± 0.3
RUN1802
MAT-POS-b3e365b9-1_1
sdf
pdb
RAL-THA-2d450e86-23_1
sdf
pdb
2.0
± 0.3
RUN6802
MAT-POS-b3e365b9-1_1
sdf
pdb
EN300-393148_2_1_1
sdf
pdb
2.0
± 0.3
RUN5361
MAT-POS-b3e365b9-1_1
sdf
pdb
EN300-21009_2_2_1
sdf
pdb
2.0
± 0.2
RUN813
MAT-POS-b3e365b9-1_1
sdf
pdb
MAK-UNK-c749d764-1_2
sdf
pdb
2.1
± 0.3
RUN1161
MAT-POS-b3e365b9-1_1
sdf
pdb
RAL-THA-8416115c-11_3
sdf
pdb
2.1
± 0.3
RUN1150
MAT-POS-b3e365b9-1_1
sdf
pdb
MIC-UNK-45817b9b-2_2
sdf
pdb
2.1
± 0.3
RUN2578
MAT-POS-b3e365b9-1_1
sdf
pdb
ALF-EVA-ced740bd-3_1
sdf
pdb
2.1
± 0.2
RUN1758
MAT-POS-b3e365b9-1_1
sdf
pdb
RAL-THA-2d450e86-3_1
sdf
pdb
2.1
± 0.3
RUN2562
MAT-POS-b3e365b9-1_1
sdf
pdb
EDG-MED-ba1ac7b9-20_4
sdf
pdb
2.1
± 0.4
RUN925
MAT-POS-b3e365b9-1_1
sdf
pdb
MAK-UNK-c749d764-15_5
sdf
pdb
2.1
± 0.6
RUN2107
MAT-POS-b3e365b9-1_1
sdf
pdb
MAT-POS-1f3f1a6f-2_2
sdf
pdb
2.1
± 0.4
RUN2451
MAT-POS-b3e365b9-1_1
sdf
pdb
EDG-MED-ba1ac7b9-4_4
sdf
pdb
2.1
± 0.6
RUN1170
MAT-POS-b3e365b9-1_1
sdf
pdb
ALP-POS-696356e4-1_2
sdf
pdb
2.1
± 0.2
RUN6520
MAT-POS-b3e365b9-1_1
sdf
pdb
EN300-29617_1_1_1
sdf
pdb
2.1
± 0.4
RUN2358
MAT-POS-b3e365b9-1_1
sdf
pdb
ALP-UNI-3496895b-15_8
sdf
pdb
2.1
± 0.3
RUN2148
MAT-POS-b3e365b9-1_1
sdf
pdb
EDG-MED-0e5afe9d-3_1
sdf
pdb
2.1
± 0.3
RUN7579
MAT-POS-b3e365b9-1_1
sdf
pdb
EN300-1448674_2_1_1
sdf
pdb
2.1
± 0.3
RUN2200
MAT-POS-b3e365b9-1_1
sdf
pdb
EDG-MED-5d232de5-5_2
sdf
pdb
2.1
± 0.3
RUN362
MAT-POS-b3e365b9-1_1
sdf
pdb
NAU-LAT-b7d8c353-8_1
sdf
pdb
2.1
± 0.1
RUN6973
MAT-POS-b3e365b9-1_1
sdf
pdb
EN300-341337_2_1_1
sdf
pdb
2.1
± 0.2
RUN7097
MAT-POS-b3e365b9-1_1
sdf
pdb
EN300-1709315_2_2_1
sdf
pdb
2.1
± 0.3
RUN1851
MAT-POS-b3e365b9-1_1
sdf
pdb
RAL-THA-05e671eb-6_2
sdf
pdb
2.1
± 0.3
RUN2262
MAT-POS-b3e365b9-1_1
sdf
pdb
ALP-POS-2da19ca7-7_3
sdf
pdb
2.1
± 0.4
RUN261
MAT-POS-b3e365b9-1_1
sdf
pdb
DAR-DIA-6a508060-10_1
sdf
pdb
2.1
± 0.2
RUN271
MAT-POS-b3e365b9-1_1
sdf
pdb
MAT-POS-8a69d52e-1_2
sdf
pdb
2.1
± 0.2
RUN662
MAT-POS-b3e365b9-1_1
sdf
pdb
MAK-UNK-ffc90da7-7_4
sdf
pdb
2.1
± 0.6
RUN1190
MAT-POS-b3e365b9-1_1
sdf
pdb
LON-WEI-5e7d1b3e-18_1
sdf
pdb
2.1
± 0.6
RUN7338
MAT-POS-b3e365b9-1_1
sdf
pdb
EN300-172020_2_1_1
sdf
pdb
2.1
± 0.2
RUN2233
MAT-POS-b3e365b9-1_1
sdf
pdb
KAD-UNI-80f122c8-5_1
sdf
pdb
2.1
± 0.4
RUN1767
MAT-POS-b3e365b9-1_1
sdf
pdb
EDG-MED-90036822-102_1
sdf
pdb
2.1
± 0.7
RUN1398
MAT-POS-b3e365b9-1_1
sdf
pdb
DAR-DIA-9e4459de-11_14
sdf
pdb
2.1
± 0.7
RUN7169
MAT-POS-b3e365b9-1_1
sdf
pdb
EN300-74856_2_2_1
sdf
pdb
2.1
± 0.3
RUN6399
MAT-POS-b3e365b9-1_1
sdf
pdb
EN300-7456641_2_1_1
sdf
pdb
2.1
± 0.3
RUN6949
MAT-POS-b3e365b9-1_1
sdf
pdb
EN300-215852_2_1_1
sdf
pdb
2.1
± 0.3
RUN504
MAT-POS-b3e365b9-1_1
sdf
pdb
MIC-UNK-bcd487e9-6_2
sdf
pdb
2.1
± 0.4
RUN168
MAT-POS-b3e365b9-1_1
sdf
pdb
LON-WEI-4d77710c-27_1
sdf
pdb
2.1
± 0.4
RUN2576
MAT-POS-b3e365b9-1_1
sdf
pdb
EDG-MED-ba1ac7b9-21_3
sdf
pdb
2.1
± 0.3
RUN1899
MAT-POS-b3e365b9-1_1
sdf
pdb
RAL-THA-05e671eb-32_1
sdf
pdb
2.1
± 0.1
RUN359
MAT-POS-b3e365b9-1_1
sdf
pdb
RAL-THA-1d44ff04-5_1
sdf
pdb
2.1
± 0.3
RUN991
MAT-POS-b3e365b9-1_1
sdf
pdb
MAT-POS-8d5af1ef-1_2
sdf
pdb
2.1
± 0.4
RUN171
MAT-POS-b3e365b9-1_1
sdf
pdb
MAT-POS-bbbbc21a-2_2
sdf
pdb
2.1
± 0.2
RUN1814
MAT-POS-b3e365b9-1_1
sdf
pdb
EDJ-MED-4c7486ba-3_1
sdf
pdb
2.1
± 0.3
RUN672
MAT-POS-b3e365b9-1_1
sdf
pdb
MAK-UNK-ffc90da7-9_3
sdf
pdb
2.1
± 0.3
RUN453
MAT-POS-b3e365b9-1_1
sdf
pdb
MAK-UNK-8be7dca9-10_3
sdf
pdb
2.13
± 0.09
RUN2601
MAT-POS-b3e365b9-1_1
sdf
pdb
EDG-MED-ba1ac7b9-30_1
sdf
pdb
2.1
± 0.6
RUN513
MAT-POS-b3e365b9-1_1
sdf
pdb
MIC-UNK-cdc2493e-18_2
sdf
pdb
2.1
± 0.3
RUN7550
MAT-POS-b3e365b9-1_1
sdf
pdb
EN300-68735_2_1_1
sdf
pdb
2.1
± 0.4
RUN1809
MAT-POS-b3e365b9-1_1
sdf
pdb
ALP-POS-869ac754-1_2
sdf
pdb
2.1
± 0.3
RUN7643
MAT-POS-b3e365b9-1_1
sdf
pdb
EN300-190026_1_4_1
sdf
pdb
2.1
± 0.4
RUN7797
MAT-POS-b3e365b9-1_1
sdf
pdb
EN300-14405_2_1_1
sdf
pdb
2.1
± 0.3
RUN1338
MAT-POS-b3e365b9-1_1
sdf
pdb
LAU-MED-88a3970a-6_1
sdf
pdb
2.1
± 0.3
RUN1373
MAT-POS-b3e365b9-1_1
sdf
pdb
DAR-DIA-9e4459de-15_13
sdf
pdb
2.1
± 0.6
RUN2647
MAT-POS-b3e365b9-1_1
sdf
pdb
EDJ-MED-ee07cf00-3_2
sdf
pdb
2.1
± 0.6
RUN6542
MAT-POS-b3e365b9-1_1
sdf
pdb
EN300-7355737_4_1_1
sdf
pdb
2.1
± 0.4
RUN430
MAT-POS-b3e365b9-1_1
sdf
pdb
MAK-UNK-8be7dca9-6_1
sdf
pdb
2.15
± 0.10
RUN7249
MAT-POS-b3e365b9-1_1
sdf
pdb
EN300-57990_2_1_1
sdf
pdb
2.2
± 0.3
RUN184
MAT-POS-b3e365b9-1_1
sdf
pdb
LON-WEI-4d77710c-52_1
sdf
pdb
2.2
± 0.4
RUN1254
MAT-POS-b3e365b9-1_1
sdf
pdb
LON-WEI-5e7d1b3e-54_1
sdf
pdb
2.2
± 0.5
RUN17
MAT-POS-b3e365b9-1_1
sdf
pdb
DAR-DIA-0cde14eb-55_1
sdf
pdb
2.2
± 0.3
RUN7691
MAT-POS-b3e365b9-1_1
sdf
pdb
EN300-7430501_2_2_1
sdf
pdb
2.2
± 0.2
RUN7297
MAT-POS-b3e365b9-1_1
sdf
pdb
EN300-246808_2_2_1
sdf
pdb
2.2
± 0.6
RUN486
MAT-POS-b3e365b9-1_1
sdf
pdb
MIC-UNK-cdc2493e-12_3
sdf
pdb
2.2
± 0.5
RUN150
MAT-POS-b3e365b9-1_1
sdf
pdb
MAT-POS-f7918075-1_2
sdf
pdb
2.2
± 0.3
RUN7621
MAT-POS-b3e365b9-1_1
sdf
pdb
EN300-781107_1_1_1
sdf
pdb
2.2
± 0.4
RUN525
MAT-POS-b3e365b9-1_1
sdf
pdb
MIC-UNK-cdc2493e-21_2
sdf
pdb
2.2
± 0.4
RUN7521
MAT-POS-b3e365b9-1_1
sdf
pdb
EN300-83527_2_1_1
sdf
pdb
2.2
± 0.2
RUN1929
MAT-POS-b3e365b9-1_1
sdf
pdb
RAL-THA-05e671eb-33_2
sdf
pdb
2.2
± 0.2
RUN7514
MAT-POS-b3e365b9-1_1
sdf
pdb
EN300-345754_2_2_1
sdf
pdb
2.2
± 0.3
RUN1567
MAT-POS-b3e365b9-1_1
sdf
pdb
EDG-MED-90036822-7_1
sdf
pdb
2.2
± 0.4
Last updated 2021-02-17T18:02:40.003401+00:00
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