xML-workFlow: an end-to-end explainable scikit-learn workflow for rapid biomedical experimentation

Fuente: arXiv
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Autori principali: Tran, Khoa A., Pearson, John V., Waddell, Nicola
Natura: Preprint
Pubblicazione: 2025
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author Tran, Khoa A.
Pearson, John V.
Waddell, Nicola
author_facet Tran, Khoa A.
Pearson, John V.
Waddell, Nicola
contents Motivation: Building and iterating machine learning models is often a resource-intensive process. In biomedical research, scientific codebases can lack scalability and are not easily transferable to work beyond what they were intended. xML-workFlow addresses this issue by providing a rapid, robust, and traceable end-to-end workflow that can be adapted to any ML project with minimal code rewriting. Results: We show a practical, end-to-end workflow that integrates scikit-learn, MLflow, and SHAP. This template significantly reduces the time and effort required to build and iterate on ML models, addressing the common challenges of scalability and reproducibility in biomedical research. Adapting our template may save bioinformaticians time in development and enables biomedical researchers to deploy ML projects. Availability and implementation: xML-workFlow is available at https://github.com/MedicalGenomicsLab/xML-workFlow.
format Preprint
id arxiv_https___arxiv_org_abs_2504_01356
institution arXiv
publishDate 2025
record_format arxiv
spellingShingle xML-workFlow: an end-to-end explainable scikit-learn workflow for rapid biomedical experimentation
Tran, Khoa A.
Pearson, John V.
Waddell, Nicola
Machine Learning
Software Engineering
D.2.3; D.2.11; I.2.5; J.3
Motivation: Building and iterating machine learning models is often a resource-intensive process. In biomedical research, scientific codebases can lack scalability and are not easily transferable to work beyond what they were intended. xML-workFlow addresses this issue by providing a rapid, robust, and traceable end-to-end workflow that can be adapted to any ML project with minimal code rewriting. Results: We show a practical, end-to-end workflow that integrates scikit-learn, MLflow, and SHAP. This template significantly reduces the time and effort required to build and iterate on ML models, addressing the common challenges of scalability and reproducibility in biomedical research. Adapting our template may save bioinformaticians time in development and enables biomedical researchers to deploy ML projects. Availability and implementation: xML-workFlow is available at https://github.com/MedicalGenomicsLab/xML-workFlow.
title xML-workFlow: an end-to-end explainable scikit-learn workflow for rapid biomedical experimentation
topic Machine Learning
Software Engineering
D.2.3; D.2.11; I.2.5; J.3
url https://arxiv.org/abs/2504.01356