PerSEveML: a web-based tool to identify persistent biomarker structure for rare events using an integrative machine learning approach†

IF 3 4区 生物学 Q3 BIOCHEMISTRY & MOLECULAR BIOLOGY
Molecular omics Pub Date : 2024-04-16 DOI:10.1039/D4MO00008K
Sreejata Dutta, Dinesh Pal Mudaranthakam, Yanming Li and Mihaela E. Sardiu
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引用次数: 0

Abstract

Omics data sets often pose a computational challenge due to their high dimensionality, large size, and non-linear structures. Analyzing these data sets becomes especially daunting in the presence of rare events. Machine learning (ML) methods have gained traction for analyzing rare events, yet there has been limited exploration of bioinformatics tools that integrate ML techniques to comprehend the underlying biology. Expanding upon our previously developed computational framework of an integrative machine learning approach, we introduce PerSEveML, an interactive web-based tool that uses crowd-sourced intelligence to predict rare events and determine feature selection structures. PerSEveML provides a comprehensive overview of the integrative approach through evaluation metrics that help users understand the contribution of individual ML methods to the prediction process. Additionally, PerSEveML calculates entropy and rank scores, which visually organize input features into a persistent structure of selected, unselected, and fluctuating categories that help researchers uncover meaningful hypotheses regarding the underlying biology. We have evaluated PerSEveML on three diverse biologically complex data sets with extremely rare events from small to large scale and have demonstrated its ability to generate valid hypotheses. PerSEveML is available at https://biostats-shinyr.kumc.edu/PerSEveML/ and https://github.com/sreejatadutta/PerSEveML.

Abstract Image

PerSEveML:使用整合机器学习方法识别罕见事件持久生物标记物结构的网络工具
由于 Omics 数据集具有维度高、规模大和非线性结构等特点,通常会给计算带来挑战。在出现罕见事件时,分析这些数据集变得尤为困难。机器学习(ML)方法在分析罕见事件方面已经获得了广泛的关注,但对整合 ML 技术以理解潜在生物学的生物信息学工具的探索仍然有限。在我们之前开发的综合机器学习方法计算框架的基础上,我们推出了基于网络的交互式工具 PerSEveML,该工具利用众包智能预测罕见事件并确定特征选择结构。PerSEveML 通过评估指标全面概述了综合方法,帮助用户了解单个 ML 方法对预测过程的贡献。此外,PerSEveML 还能计算熵和等级分数,直观地将输入特征组织成一个由选定、未选定和波动类别组成的持久结构,帮助研究人员发现有关潜在生物学的有意义的假设。我们已经在三个不同的复杂生物数据集上对 PerSEveML 进行了评估,这些数据集包含从小到大的极其罕见的事件,并证明了它生成有效假设的能力。PerSEveML 可在 https://biostats-shinyr.kumc.edu/PerSEveML/ 和 https://github.com/sreejatadutta/PerSEveML 上查阅。
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来源期刊
Molecular omics
Molecular omics Biochemistry, Genetics and Molecular Biology-Biochemistry
CiteScore
5.40
自引率
3.40%
发文量
91
期刊介绍: Molecular Omics publishes high-quality research from across the -omics sciences. Topics include, but are not limited to: -omics studies to gain mechanistic insight into biological processes – for example, determining the mode of action of a drug or the basis of a particular phenotype, such as drought tolerance -omics studies for clinical applications with validation, such as finding biomarkers for diagnostics or potential new drug targets -omics studies looking at the sub-cellular make-up of cells – for example, the subcellular localisation of certain proteins or post-translational modifications or new imaging techniques -studies presenting new methods and tools to support omics studies, including new spectroscopic/chromatographic techniques, chip-based/array technologies and new classification/data analysis techniques. New methods should be proven and demonstrate an advance in the field. Molecular Omics only accepts articles of high importance and interest that provide significant new insight into important chemical or biological problems. This could be fundamental research that significantly increases understanding or research that demonstrates clear functional benefits. Papers reporting new results that could be routinely predicted, do not show a significant improvement over known research, or are of interest only to the specialist in the area are not suitable for publication in Molecular Omics.
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