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Record W4405975816 · doi:10.1101/2024.12.18.629275

Probabilistic Annotations of Protein Sequences for Intrinsically Disordered Features

2024· preprint· en· W4405975816 on OpenAlexaff
Nawar Malhis

Bibliographic record

VenuebioRxiv (Cold Spring Harbor Laboratory) · 2024
Typepreprint
Languageen
FieldBiochemistry, Genetics and Molecular Biology
TopicMachine Learning in Bioinformatics
Canadian institutionsCanada's Michael Smith Genome Sciences CentreUniversity of British Columbia
Fundersnot available
KeywordsProbabilistic logicIntrinsically disordered proteinsComputational biologyComputer scienceStatistical physicsArtificial intelligenceBiologyPhysicsBiophysics

Abstract

fetched live from OpenAlex

Abstract This paper introduces a novel platform for IDR Probabilistic Annotation (IPA). The IPA platform now encompasses tools for predicting ‘Linker’ regions and ‘nucleic’, ‘protein’, and ‘all’ (protein or nucleic) IDR binding sites within protein amino acid sequences. Despite its simplicity and computational efficiency, results demonstrate that IPA performs competitively with leading tools in predicting ‘protein’ and ‘all’ IDR binding sites while considerably outperforming all tools in identifying Linker regions and nucleic binding sites. An important contribution of this work is the introduction of a new output paradigm for computational feature predictions. Traditional tools typically express predictions as scores, with higher values indicating greater probabilities. However, these scores lack true probabilistic meaning and interpretability, even derived from logistic regression models. This limitation arises primarily because training data priors differ from broader populations’ unknown priors. This paper proposes applying a reverse Bayes Rule to logistic regression outputs, effectively normalizing for the priors in the training data. This adjustment produces scores representing actual probabilities, assuming 50% priors in the general population. Such scores are interpretable in isolation and enable comparability and integration across different tools, marking a significant step toward standardization in feature prediction methodologies. Availability orca.msl.ubc.ca/nmshare/ipa.tar.gz

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.

How this classification was reachedexpand

Full frame machine prediction

Teacher imitation

Not calibrated prevalence, not ground truth. Human validation pending. The Gemma side is a direct model label for every work in the frame, read from the title-only record. The Codex side is a classifier learned from the 10,348 direct Codex labels and calibrated to design-weighted sample rates; fields without enough sample support carry no Codex call. Candidate is the union of the two sides; consensus is their intersection. These outputs are machine_predicted_unvalidated and are not human labels.

metaresearch head score (Codex)0.002
metaresearch head score (Gemma)0.011
Version: metacan-v3-hybrid-931329e0061cValidation status: machine_predicted_unvalidated
Candidate categoriesnone
Consensus categoriesnone
DomainCandidate signal: none · Consensus signal: none
Study designCandidate signal: Simulation or modeling · Consensus signal: none
GenreCandidate signal: Empirical · Consensus signal: none
Teacher disagreement score0.003
Threshold uncertainty score0.010

Distilled classifier scores by category (both heads)

CategoryCodexGemma
Metaresearch0.0020.011
Meta-epidemiology (narrow)0.0010.000
Meta-epidemiology (broad)0.0000.001
Bibliometrics0.0020.002
Science and technology studies0.0000.001
Scholarly communication0.0010.001
Open science0.0010.001
Research integrity0.0010.001
Insufficient payload (model declined to judge)0.0030.002

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 head0.008
GPT teacher head0.239
Teacher spread0.231 · 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

Classification

machine, unvalidated

Machine predicted; a candidate call from one source (direct Gemma or distilled Codex), not a consensus.

The models applied no category: nothing in the taxonomy fit this work.
Study designSimulation or modeling
Domainnot available
GenreEmpirical

How this classification was reached, model by model and score by score, is at the end of the page under "How this classification was reached".

Quick stats

Citations4
Published2024
Admission routes1
Has abstractyes

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Same venuebioRxiv (Cold Spring Harbor Laboratory)Same topicMachine Learning in BioinformaticsFrench-language works237,207