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Record W4386607677 · doi:10.1038/s41573-023-00774-7

Artificial intelligence for natural product drug discovery

2023· review· en· W4386607677 on OpenAlex

Why this work is in the frame

A frame that forgets how it found something cannot be audited. These are the routes that admitted this work.

affAt least one author lists a Canadian institution in the pinned OpenAlex snapshot.

Bibliographic record

VenueNature Reviews Drug Discovery · 2023
Typereview
Languageen
FieldComputer Science
TopicComputational Drug Discovery Methods
Canadian institutionsCanada's Michael Smith Genome Sciences CentreUniversity of British ColumbiaSimon Fraser University
FundersDuke Cancer InstituteNational Center for Complementary and Integrative HealthIndustrial Biotechnology Innovation CentreU.S. National Library of MedicineNational Institute of Diabetes and Digestive and Kidney DiseasesBiotechnology and Biological Sciences Research CouncilCenter for Gastrointestinal Biology and Disease, School of Medicine, University of North Carolina at Chapel HillVlaamse regeringMinistry of Science and ICT, South KoreaNovo NordiskNational Research Foundation of KoreaDirectorate for Biological SciencesNational Institutes of HealthSchweizerischer Nationalfonds zur Förderung der Wissenschaftlichen ForschungDeutsche ForschungsgemeinschaftNorth Carolina Biotechnology CenterAgence Nationale de la RechercheNovo Nordisk FondenNetherlands eScience CenterNational Cancer InstituteNational Research FoundationNational Science FoundationUK Research and InnovationUniversity of ChicagoUniversiteit LeidenKorea Advanced Institute of Science and Technology
KeywordsDrug discoveryNatural productDrugComputer scienceData sciencePharmacologyComputational biologyMedicineChemistryBioinformaticsBiologyStereochemistry

Abstract

fetched live from OpenAlex
No abstract in any covered source. Its absence is recorded, not treated as a negative.

No abstract. This is not a gap in this database; OpenAlex has none either. 23.3% of the frame is in this state, and the screen finds HALF as much metaresearch here, so the absence is a measured bias rather than a missing field.

Full frame distilled prediction

Teacher imitation

Not calibrated prevalence, not ground truth. Human validation pending. Learned from the 10,348 direct Codex labels and 10,348 direct Gemma labels. Candidate is the union of thresholded teacher heads; consensus is their intersection. These outputs are machine_predicted_unvalidated and are not human labels or direct frontier model labels.

metaresearch head score (Codex)0.006
metaresearch head score (Gemma)0.004
Version: codex-gemma-dda1882f352aValidation status: machine_predicted_unvalidated
Candidate categoriesMeta-epidemiology (narrow), Scholarly communication, Open science, Research integrity
Consensus categoriesMeta-epidemiology (narrow)
DomainCandidate signal: none · Consensus signal: none
Study designCandidate signal: Not applicable · Consensus signal: none
GenreCandidate signal: Review · Consensus signal: Review
Teacher disagreement score0.927
Threshold uncertainty score0.999

Codex and Gemma teacher scores by category

CategoryCodexGemma
Metaresearch0.0060.004
Meta-epidemiology (narrow)0.0020.002
Meta-epidemiology (broad)0.0060.004
Bibliometrics0.0010.005
Science and technology studies0.0000.000
Scholarly communication0.0030.005
Open science0.0070.002
Research integrity0.0010.004
Insufficient payload (model declined to judge)0.0000.001

Machine scores (provisional)

The two teacher heads of the student model, read on this work. A score orders the frame for review; it never asserts a category, and the validation status ships verbatim with every row.

Baseline scores from an immature model (maturity gate not passed, 7 training rounds). Scores rank; they never assert a category.

Opus teacher head0.096
GPT teacher head0.417
Teacher spread0.320 · how far apart the two teachers sit on this one work
Validation statusscore_only:v0-immature-baseline · verbatim from the scoring run: score_only means the number may rank works, and no category label ships from it