| chemistry |
bde-weak-bonds |
1/1 |
1/1 |
2/2 (100.0%) |
102m/114m |
89.6k/141.0k |
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| chemistry |
conformer-boltzmann-ranking |
1/1 |
0/1 |
1/2 (50.0%) |
34m/100m |
58.7k/123.0k |
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| chemistry |
gas-thermochemistry-equilibrium |
1/1 |
0/1 |
1/2 (50.0%) |
15m/15m |
27.4k/28.4k |
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| chemistry |
ghs-hazard-summary |
1/1 |
0/1 |
1/2 (50.0%) |
501s/23m |
13.6k/52.1k |
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| chemistry |
ir-spectrum-match |
1/1 |
1/1 |
2/2 (100.0%) |
536s/13m |
18.9k/29.4k |
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| chemistry |
mof-dac-screening |
0/1 |
1/1 |
1/2 (50.0%) |
54m/122m |
74.2k/199.7k |
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| chemistry |
nmr-reaction-kinetics |
0/1 |
1/1 |
1/2 (50.0%) |
472s/13m |
10.7k/27.0k |
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| drug-discovery |
admet-lead-triage |
1/1 |
1/1 |
2/2 (100.0%) |
239s/258s |
8.9k/8.7k |
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| drug-discovery |
docking-microstate-enrichment |
1/1 |
0/1 |
1/2 (50.0%) |
38m/50m |
90.9k/114.0k |
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| drug-discovery |
ecfp-analog-diversity |
1/1 |
1/1 |
2/2 (100.0%) |
220s/215s |
6.6k/7.4k |
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| drug-discovery |
ligand-box-definition |
1/1 |
1/1 |
2/2 (100.0%) |
365s/279s |
15.3k/7.6k |
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| drug-discovery |
ligand-md-stability |
1/1 |
1/1 |
2/2 (100.0%) |
501s/21m |
19.3k/37.0k |
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| drug-discovery |
pose-quality-filter |
1/1 |
1/1 |
2/2 (100.0%) |
306s/307s |
8.3k/7.8k |
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| drug-discovery |
symmetry-redocking-rmsd |
1/1 |
1/1 |
2/2 (100.0%) |
226s/362s |
7.5k/11.3k |
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| machine-learning |
committee-uncertainty-flagging |
1/1 |
1/1 |
2/2 (100.0%) |
356s/385s |
9.7k/9.6k |
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| machine-learning |
mlip-error-benchmark |
1/1 |
1/1 |
2/2 (100.0%) |
477s/413s |
10.2k/9.3k |
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| materials-science |
camgsi-elasticity-vrh |
1/1 |
1/1 |
2/2 (100.0%) |
80m/65m |
93.1k/201.1k |
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| materials-science |
co-adsorption-cu111 |
1/1 |
1/1 |
2/2 (100.0%) |
56m/54m |
71.1k/58.1k |
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| materials-science |
convex-hull-stability |
1/1 |
0/1 |
1/2 (50.0%) |
20m/60m |
28.7k/97.7k |
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| materials-science |
crconi-order-disorder |
1/1 |
1/1 |
2/2 (100.0%) |
194m/138m |
224.9k/168.7k |
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| materials-science |
electrochemical-window |
1/1 |
1/1 |
2/2 (100.0%) |
54m/56m |
66.1k/85.6k |
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| materials-science |
li-qha-simulation |
0/1 |
0/1 |
0/2 (0.0%) |
39m/43m |
63.9k/55.6k |
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| materials-science |
lifepo4-intercalation-voltage |
1/1 |
1/1 |
2/2 (100.0%) |
25m/27m |
21.0k/31.5k |
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| materials-science |
mgo-vacancy-energy |
0/1 |
1/1 |
1/2 (50.0%) |
23m/19m |
31.1k/29.6k |
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| materials-science |
ni3al-surface-energy |
1/1 |
1/1 |
2/2 (100.0%) |
50m/89m |
53.6k/121.3k |
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| materials-science |
nist-janaf-query |
1/1 |
1/1 |
2/2 (100.0%) |
108s/160s |
2.4k/4.8k |
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| materials-science |
polymorph-free-energy |
1/1 |
0/1 |
1/2 (50.0%) |
65m/120m |
62.0k/156.2k |
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| materials-science |
si-eos-fit |
1/1 |
1/1 |
2/2 (100.0%) |
10m/11m |
15.1k/17.2k |
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| materials-science |
sic-thermal-conductivity |
1/1 |
1/1 |
2/2 (100.0%) |
20m/26m |
31.9k/33.2k |
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| materials-science |
synthesis-precursor-recommendation |
1/1 |
1/1 |
2/2 (100.0%) |
141s/34m |
3.5k/64.1k |
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| materials-science |
xrd-mixture-phase-fit |
1/1 |
1/1 |
2/2 (100.0%) |
22m/15m |
27.7k/22.6k |
View Details → |