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4,299,418 works, Canadian by any of four routes.

Every filter state is a URL; the URL is the query; the query is citable via /q/⟨hash⟩. The page, the API and the export parse the same parameters.

The current cohort, streamed from the database: every work column, the machine labels, the provisional scores, and the per-row validation status. Exports are capped at 100,000 rows. Mints a permanent /q/ link for this exact query. The same filters always produce the same link, whoever asks.

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Journal of Computational Chemistry
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Direct Codex and Gemma labels are unvalidated and sparse. Distilled predictions cover the full frame and are also unvalidated. Choose the evidence source explicitly; absence of a direct label is never a negative label.

affaffiliation
fundfunder
venuejournal
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The four routes compose: require the funder route and exclude affiliation to get the funder-only stratum no affiliation-based frame ever sees.

167 results · 1 filter active ·
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20002025
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Machine labels · sparse coverage
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An unlabeled work is unknown, not a negative. Label coverage is reported on every query.
167 works in the cohort · of 4,299,418page 1 of 4

Labels cover 2 of 167 works in this cohort. The rest are unlabeled, which is not a negative label: the label table is sparse today and grows as labeling rounds land.

Distilled predictions cover 167 of 167 works in this cohort. Predictions are machine_predicted_unvalidated teacher distillation outputs. Candidate is the union; consensus is the intersection.

affunlabeled
Chemistry with ADF
G. te Velde, F. Matthias Bickelhaupt, Evert Jan Baerends, Célia Fonseca Guerra, S. J. A. van Gisbergen, J. G. Snijders +1 more
2001· article· en· Journal of Computational Chemistry· Physics and Astronomy
distilled prediction:candidate · noneconsensus · none
10,049
citations
affunlabeled
Nine questions on energy decomposition analysis
Juán Andrés, Paul W. Ayers, Roberto A. Boto, Ramon Carbó‐Dorca, Henry Chermette, Jerzy Ciosłowski +23 more
2019· article· en· Journal of Computational Chemistry· Materials Science
distilled prediction:candidate · insufficient_payloadconsensus · none
153
citations
fundno affunlabeled
Metal–thiolate bonds in bioinorganic chemistry
Edward I. Solomon, Serge I. Gorelsky, Abhishek Dey
2006· review· en· Journal of Computational Chemistry· Medicine
distilled prediction:candidate · metaepi_narrowconsensus · none
132
citations
affunlabeled
An algorithm for three‐dimensional Voronoi S‐network
N. N. Medvedev, V. P. Voloshin, Valériy Luchnikov, Marina L. Gavrilova
2006· article· en· Journal of Computational Chemistry· Computer Science
distilled prediction:candidate · noneconsensus · none
101
citations
affunlabeled
Chemical bonding: From Lewis to atoms in molecules
R. F. W. Bader, Jesús Hernández‐Trujillo, Fernando Cortés‐Guzmán
2006· article· en· Journal of Computational Chemistry· Chemistry
distilled prediction:candidate · noneconsensus · none
99
citations
affunlabeled
Structure and stability of β‐pleated sheets*
András Perczel, Zoltán Gáspári, Imre G. Csizmadia
2005· article· en· Journal of Computational Chemistry· Biochemistry, Genetics and Molecular Biology
distilled prediction:candidate · noneconsensus · none
73
citations
affunlabeled
Polarized basis sets of Slater‐type orbitals: H to Ne atoms
I. Ema, José M. Garcı́a de la Vega, G. Ramı́rez, R. López, J. Fernández Rico, Holger Meißner +1 more
2003· article· en· Journal of Computational Chemistry· Physics and Astronomy
distilled prediction:candidate · noneconsensus · none
68
citations
affunlabeled
On the flexibility of β‐peptides
Tamás Beke‐Somfai, Imre G. Csizmadia, András Perczel
2003· article· en· Journal of Computational Chemistry· Biochemistry, Genetics and Molecular Biology
distilled prediction:candidate · noneconsensus · none
54
citations
afffundunlabeled
Quantum crystallography: A perspective
Lou Massa, Chérif F. Matta
2017· article· en· Journal of Computational Chemistry· Materials Science
distilled prediction:candidate · noneconsensus · none
44
citations

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