| chemistry |
bde-weak-bonds |
1/1 |
1/1 |
2/2 (100.0%) |
70m/41m |
14.1k/22.5k |
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| chemistry |
conformer-boltzmann-ranking |
1/1 |
0/1 |
1/2 (50.0%) |
42m/19m |
33.2k/36.5k |
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| chemistry |
gas-thermochemistry-equilibrium |
1/1 |
1/1 |
2/2 (100.0%) |
268s/121s |
11.4k/12.5k |
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| chemistry |
ghs-hazard-summary |
1/1 |
0/1 |
1/2 (50.0%) |
132s/243s |
3.7k/24.8k |
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| chemistry |
ir-spectrum-match |
1/1 |
1/1 |
2/2 (100.0%) |
129s/88s |
8.6k/9.8k |
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| chemistry |
mof-dac-screening |
1/1 |
1/1 |
2/2 (100.0%) |
10m/498s |
24.6k/30.1k |
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| chemistry |
nmr-reaction-kinetics |
1/1 |
1/1 |
2/2 (100.0%) |
226s/345s |
9.1k/26.9k |
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| drug-discovery |
admet-lead-triage |
1/1 |
1/1 |
2/2 (100.0%) |
142s/68s |
17.3k/24.5k |
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| drug-discovery |
docking-microstate-enrichment |
1/1 |
1/1 |
2/2 (100.0%) |
318s/248s |
64.4k/46.9k |
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| drug-discovery |
ecfp-analog-diversity |
1/1 |
1/1 |
2/2 (100.0%) |
50s/36s |
4.9k/10.0k |
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| drug-discovery |
ligand-box-definition |
1/1 |
1/1 |
2/2 (100.0%) |
187s/43s |
20.3k/8.8k |
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| drug-discovery |
ligand-md-stability |
1/1 |
1/1 |
2/2 (100.0%) |
177s/66s |
22.0k/12.8k |
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| drug-discovery |
pose-quality-filter |
1/1 |
1/1 |
2/2 (100.0%) |
64s/58s |
4.3k/6.5k |
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| drug-discovery |
symmetry-redocking-rmsd |
1/1 |
1/1 |
2/2 (100.0%) |
77s/69s |
8.3k/7.7k |
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| machine-learning |
committee-uncertainty-flagging |
1/1 |
1/1 |
2/2 (100.0%) |
229s/57s |
9.2k/6.4k |
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| machine-learning |
mlip-error-benchmark |
1/1 |
1/1 |
2/2 (100.0%) |
166s/147s |
8.0k/14.5k |
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| materials-science |
camgsi-elasticity-vrh |
1/1 |
0/1 |
1/2 (50.0%) |
215s/453s |
19.2k/57.8k |
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| materials-science |
co-adsorption-cu111 |
1/1 |
1/1 |
2/2 (100.0%) |
25m/23m |
24.2k/18.6k |
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| materials-science |
convex-hull-stability |
1/1 |
1/1 |
2/2 (100.0%) |
16m/38m |
18.1k/39.0k |
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| materials-science |
crconi-order-disorder |
1/1 |
1/1 |
2/2 (100.0%) |
38m/43m |
43.3k/49.6k |
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| materials-science |
electrochemical-window |
1/1 |
1/1 |
2/2 (100.0%) |
17m/49m |
35.5k/18.8k |
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| materials-science |
li-qha-simulation |
1/1 |
0/1 |
1/2 (50.0%) |
15m/14m |
25.1k/50.1k |
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| materials-science |
lifepo4-intercalation-voltage |
1/1 |
1/1 |
2/2 (100.0%) |
14m/558s |
8.9k/9.3k |
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| materials-science |
mgo-vacancy-energy |
1/1 |
1/1 |
2/2 (100.0%) |
452s/26m |
9.3k/18.5k |
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| materials-science |
ni3al-surface-energy |
1/1 |
1/1 |
2/2 (100.0%) |
11m/17m |
18.2k/20.5k |
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| materials-science |
nist-janaf-query |
1/1 |
1/1 |
2/2 (100.0%) |
69s/88s |
4.8k/13.6k |
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| materials-science |
polymorph-free-energy |
1/1 |
0/1 |
1/2 (50.0%) |
92m/118m |
17.0k/54.3k |
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| materials-science |
si-eos-fit |
1/1 |
1/1 |
2/2 (100.0%) |
196s/178s |
14.3k/11.4k |
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| materials-science |
sic-thermal-conductivity |
1/1 |
0/1 |
1/2 (50.0%) |
581s/12m |
8.7k/12.8k |
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| materials-science |
synthesis-precursor-recommendation |
1/1 |
1/1 |
2/2 (100.0%) |
63s/72s |
5.6k/4.1k |
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| materials-science |
xrd-mixture-phase-fit |
1/1 |
1/1 |
2/2 (100.0%) |
21m/260s |
24.5k/30.1k |
View Details → |