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RepoRT Meta-analysis

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Figshare2026-03-06 更新2026-04-28 收录
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https://figshare.com/articles/dataset/RepoRT_Meta-analysis/31553716
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Overview This repository contains a Julia-based analytical pipeline for processing method and reported compound datasets imported from https://github.com/michaelwitting/RepoRT.File Registry Notebooks Meta-analysis_markdown.ipynb Main workflow containing data cleaning, statistical meta-analysis, and visualization logic. Data Sources (CSV) pca_dataset_comptox_EU_MWscal_EMDs.csv Dataset containing molecular descriptors of CompTox entries. updated_rt_data.csv Refined retention time and compound dataset from RepoRT. compiled_method_metadata.csv Metadata describing experimental conditions for each method. Julia Data Objects (JLD2) pca_compound_results.jld2 Serialized Julia objects containing PCA scores and loadings specific to individual chemical compounds. pca_method_results.jld2 Results grouped by experimental methodology to evaluate inter-method variance. pca_RepoRT_CompTox.jld2 Final processed data for RepoRT vs CompTox chemical coverage. Environment Setup Language: Julia 1.9+
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2026-03-06
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