| chemistry |
bde-weak-bonds |
1/1 |
0/1 |
1/2 (50.0%) |
63m/29m |
92.4k/43.7k |
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| chemistry |
conformer-boltzmann-ranking |
1/1 |
1/1 |
2/2 (100.0%) |
63m/143m |
86.7k/137.3k |
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| chemistry |
gas-thermochemistry-equilibrium |
1/1 |
0/1 |
1/2 (50.0%) |
73m/74m |
123.9k/143.4k |
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| chemistry |
ghs-hazard-summary |
0/1 |
0/1 |
0/2 (0.0%) |
36m/28m |
38.4k/27.9k |
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| chemistry |
ir-spectrum-match |
1/1 |
1/1 |
2/2 (100.0%) |
16m/29m |
13.5k/10.9k |
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| chemistry |
mof-dac-screening |
1/1 |
0/1 |
1/2 (50.0%) |
33m/24m |
43.1k/42.8k |
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| chemistry |
nmr-reaction-kinetics |
1/1 |
0/1 |
1/2 (50.0%) |
79m/160m |
53.7k/127.1k |
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| drug-discovery |
admet-lead-triage |
1/1 |
1/1 |
2/2 (100.0%) |
23m/581s |
46.1k/21.8k |
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| drug-discovery |
docking-microstate-enrichment |
0/1 |
0/1 |
0/2 (0.0%) |
124m/95m |
99.1k/57.1k |
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| drug-discovery |
ecfp-analog-diversity |
1/1 |
1/1 |
2/2 (100.0%) |
35m/29m |
15.8k/10.1k |
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| drug-discovery |
ligand-box-definition |
1/1 |
1/1 |
2/2 (100.0%) |
24m/15m |
30.4k/21.4k |
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| drug-discovery |
ligand-md-stability |
1/1 |
1/1 |
2/2 (100.0%) |
499s/28m |
17.0k/46.8k |
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| drug-discovery |
pose-quality-filter |
1/1 |
1/1 |
2/2 (100.0%) |
13m/13m |
21.3k/19.1k |
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| drug-discovery |
symmetry-redocking-rmsd |
1/1 |
1/1 |
2/2 (100.0%) |
260s/29m |
7.1k/45.4k |
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| machine-learning |
committee-uncertainty-flagging |
1/1 |
1/1 |
2/2 (100.0%) |
366s/308s |
8.5k/6.7k |
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| machine-learning |
mlip-error-benchmark |
0/1 |
0/1 |
0/2 (0.0%) |
10m/17m |
20.5k/32.2k |
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| materials-science |
camgsi-elasticity-vrh |
0/1 |
0/1 |
0/2 (0.0%) |
296m/486m |
459.9k/812.8k |
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| materials-science |
co-adsorption-cu111 |
1/1 |
1/1 |
2/2 (100.0%) |
37m/25m |
57.9k/40.3k |
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| materials-science |
convex-hull-stability |
1/1 |
0/1 |
1/2 (50.0%) |
54m/75m |
100.2k/135.4k |
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| materials-science |
crconi-order-disorder |
1/1 |
0/1 |
1/2 (50.0%) |
588m/368m |
787.1k/559.2k |
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| materials-science |
electrochemical-window |
1/1 |
0/1 |
1/2 (50.0%) |
43m/215m |
65.7k/339.1k |
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| materials-science |
li-qha-simulation |
0/1 |
0/1 |
0/2 (0.0%) |
170m/86m |
272.0k/141.6k |
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| materials-science |
lifepo4-intercalation-voltage |
0/1 |
0/1 |
0/2 (0.0%) |
21m/45m |
40.6k/81.7k |
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| materials-science |
mgo-vacancy-energy |
1/1 |
1/1 |
2/2 (100.0%) |
68m/68m |
114.0k/115.2k |
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| materials-science |
ni3al-surface-energy |
0/1 |
0/1 |
0/2 (0.0%) |
252m/23m |
307.4k/44.7k |
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| materials-science |
nist-janaf-query |
1/1 |
1/1 |
2/2 (100.0%) |
110s/69s |
2.7k/1.9k |
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| materials-science |
polymorph-free-energy |
1/1 |
1/1 |
2/2 (100.0%) |
352m/1076m |
228.2k/1280.9k |
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| materials-science |
si-eos-fit |
1/1 |
1/1 |
2/2 (100.0%) |
58m/31m |
88.1k/42.7k |
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| materials-science |
sic-thermal-conductivity |
1/1 |
0/1 |
1/2 (50.0%) |
47m/53m |
28.4k/77.8k |
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| materials-science |
synthesis-precursor-recommendation |
1/1 |
1/1 |
2/2 (100.0%) |
12m/28m |
24.0k/54.1k |
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| materials-science |
xrd-mixture-phase-fit |
1/1 |
1/1 |
2/2 (100.0%) |
70m/173m |
136.4k/287.6k |
View Details → |