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iEnhancer-XG:基于序列的可解释增强子及其强度预测器。

iEnhancer-XG: interpretable sequence-based enhancers and their strength predictor.

机构信息

College of Computer Science and Electronic Engineering, Hunan University, 410082 Changsha, Hunan, China.

College of Computer Science and Engineering, Hunan University of Science and Technology, 411103 XiangTan, China.

出版信息

Bioinformatics. 2021 May 23;37(8):1060-1067. doi: 10.1093/bioinformatics/btaa914.

Abstract

MOTIVATION

Enhancers are non-coding DNA fragments with high position variability and free scattering. They play an important role in controlling gene expression. As machine learning has become more widely used in identifying enhancers, a number of bioinformatic tools have been developed. Although several models for identifying enhancers and their strengths have been proposed, their accuracy and efficiency have yet to be improved.

RESULTS

We propose a two-layer predictor called 'iEnhancer-XG.' It comprises a one-layer predictor (for identifying enhancers) and a second classifier (for their strength) and uses 'XGBoost' as a base classifier and five feature extraction methods, namely, k-Spectrum Profile, Mismatch k-tuple, Subsequence Profile, Position-specific scoring matrix (PSSM) and Pseudo dinucleotide composition (PseDNC). Each method has an independent output. We place the feature vector matrix into the ensemble learning for fusion. This experiment involves the method of 'SHapley Additive explanations' to provide interpretability for the previous black box machine learning methods and improve their credibility. The accuracies of the ensemble learning method are 0.811 (first layer) and 0.657 (second layer). The rigorous 10-fold cross-validation confirms that the proposed method is significantly better than existing technologies.

AVAILABILITY AND IMPLEMENTATION

The source code and dataset for the enhancer predictions have been uploaded to https://github.com/jimmyrate/ienhancer-xg.

SUPPLEMENTARY INFORMATION

Supplementary data are available at Bioinformatics online.

摘要

动机

增强子是非编码 DNA 片段,具有高位置可变性和自由散射。它们在控制基因表达中起着重要作用。随着机器学习在识别增强子方面的应用越来越广泛,已经开发出了许多生物信息学工具。尽管已经提出了几种识别增强子及其强度的模型,但它们的准确性和效率仍有待提高。

结果

我们提出了一个称为“iEnhancer-XG”的两层预测器。它由一个单层预测器(用于识别增强子)和第二个分类器(用于其强度)组成,并使用“XGBoost”作为基本分类器和五种特征提取方法,即 k-光谱分布、错配 k-元、子序列分布、位置特异性评分矩阵(PSSM)和伪二核苷酸组成(PseDNC)。每种方法都有独立的输出。我们将特征向量矩阵放入集成学习中进行融合。该实验涉及“Shapley 加法解释”方法,为先前的黑盒机器学习方法提供可解释性,并提高其可信度。集成学习方法的准确率为 0.811(第一层)和 0.657(第二层)。严格的 10 倍交叉验证证实,所提出的方法明显优于现有技术。

可用性和实现

增强子预测的源代码和数据集已上传至 https://github.com/jimmyrate/ienhancer-xg。

补充信息

补充数据可在 Bioinformatics 在线获得。

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