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Record W7017688965

CAPRI- Content-based Analysis of Protein Structure for Retrieval and Indexing

2015· article· en· W7017688965 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.

fundA Canadian funder is recorded on the work.
venuePublished in a venue whose home country is Canada.
no affNo Canadian affiliation: this work is invisible to an affiliation-only frame.
No Canadian affiliation. An affiliation-only frame, the usual design, would never have seen this work. It is one of the works that make the case for inverting the frame.

Bibliographic record

VenueNPARC · 2015
Typearticle
Languageen
FieldBiochemistry, Genetics and Molecular Biology
TopicMachine Learning in Bioinformatics
Canadian institutionsnot available
FundersNatural Sciences and Engineering Research Council of Canada
KeywordsProtein structure databaseSearch engine indexingProtein structureProtein Data BankTask (project management)Domain (mathematical analysis)Protein domain
DOInot available

Abstract

fetched live from OpenAlex

In molecular biology, current research suggests that the function of a protein may be inferred from its structure. Two proteins with similar local parts (or active sites) and shape are often closely related. This observation is of importance when determining the adverse effects of new medicine, identifying new protein architectures, predicting protein interactions such as the docking-problem (where the so-called receptor connects to the ligand) and explaining unexpected evolutions. Due to the vast amounts of newly discovered protein structures, there is an urgent need for multimedia data mining systems which can efficiently find similar proteins structures, based on both shape and physical properties. In this paper, we describe the Content-based Analysis of Protein Structure for Retrieval and Indexing (CAPRI) data mining system, which is used to explore very large multimedia databases containing numerous protein structure families. CAPRI is able to find similar proteins based on their structure, by utilizing firstly, the 2D colours, textures and composition and secondly, the 3D structure of the proteins. Our results against more than 26,000 protein structures as contained in the Protein Data Bank shows that our system is able to accurately and efficiently locate related protein structures. Through the use of the CAPRI system, domain experts are able to find these similar protein structures, using a “query by prototype ” example. In this way, they are aided in the task of labelling new structures effectively, finding the families of existing proteins, identifying mutations and explaining unexpected evolutions. 1.

Fetched live from OpenAlex and de-inverted. Abstracts are not stored in this database: the inverted indexes are 8.6 GB of the frame’s 9.3 GB of text, and the host has 13 GB free.

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)0.000
metaresearch head score (Gemma)0.000
Version: codex-gemma-dda1882f352aValidation status: machine_predicted_unvalidated
Candidate categoriesnone
Consensus categoriesnone
DomainCandidate signal: none · Consensus signal: none
Study designCandidate signal: Bench or experimental · Consensus signal: Bench or experimental
GenreCandidate signal: Empirical · Consensus signal: Empirical
Teacher disagreement score0.059
Threshold uncertainty score0.256

Codex and Gemma teacher scores by category

CategoryCodexGemma
Metaresearch0.0000.000
Meta-epidemiology (narrow)0.0000.000
Meta-epidemiology (broad)0.0000.000
Bibliometrics0.0000.000
Science and technology studies0.0000.000
Scholarly communication0.0000.000
Open science0.0000.000
Research integrity0.0000.000
Insufficient payload (model declined to judge)0.0000.000

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 head0.025
GPT teacher head0.269
Teacher spread0.243 · 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