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用于二硫键连接预测的软计算方法

Soft Computing Methods for Disulfide Connectivity Prediction.

作者信息

Márquez-Chamorro Alfonso E, Aguilar-Ruiz Jesús S

机构信息

School of Engineering, Pablo de Olavide University, Seville, Spain.

出版信息

Evol Bioinform Online. 2015 Oct 20;11:223-9. doi: 10.4137/EBO.S25349. eCollection 2015.

DOI:10.4137/EBO.S25349
PMID:26523116
原文链接:https://pmc.ncbi.nlm.nih.gov/articles/PMC4620934/
Abstract

The problem of protein structure prediction (PSP) is one of the main challenges in structural bioinformatics. To tackle this problem, PSP can be divided into several subproblems. One of these subproblems is the prediction of disulfide bonds. The disulfide connectivity prediction problem consists in identifying which nonadjacent cysteines would be cross-linked from all possible candidates. Determining the disulfide bond connectivity between the cysteines of a protein is desirable as a previous step of the 3D PSP, as the protein conformational search space is highly reduced. The most representative soft computing approaches for the disulfide bonds connectivity prediction problem of the last decade are summarized in this paper. Certain aspects, such as the different methodologies based on soft computing approaches (artificial neural network or support vector machine) or features of the algorithms, are used for the classification of these methods.

摘要

蛋白质结构预测(PSP)问题是结构生物信息学中的主要挑战之一。为了解决这个问题,PSP可分为几个子问题。其中一个子问题是二硫键预测。二硫键连接性预测问题在于从所有可能的候选者中识别出哪些不相邻的半胱氨酸会发生交联。确定蛋白质中半胱氨酸之间的二硫键连接性作为三维PSP的前一步是很有必要的,因为蛋白质构象搜索空间会大大缩小。本文总结了过去十年中用于二硫键连接性预测问题的最具代表性的软计算方法。基于软计算方法(人工神经网络或支持向量机)的不同方法或算法特征等某些方面被用于这些方法的分类。

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本文引用的文献

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Disulfide Connectivity Prediction Based on Modelled Protein 3D Structural Information and Random Forest Regression.基于蛋白质三维结构信息建模和随机森林回归的二硫键连接预测
IEEE/ACM Trans Comput Biol Bioinform. 2015 May-Jun;12(3):611-21. doi: 10.1109/TCBB.2014.2359451.
2
An Evolutionary View on Disulfide Bond Connectivities Prediction Using Phylogenetic Trees and a Simple Cysteine Mutation Model.基于系统发育树和简单半胱氨酸突变模型的二硫键连接性预测的进化观点
PLoS One. 2015 Jul 10;10(7):e0131792. doi: 10.1371/journal.pone.0131792. eCollection 2015.
3
Clustering-based model of cysteine co-evolution improves disulfide bond connectivity prediction and reduces homologous sequence requirements.基于聚类的半胱氨酸共进化模型改善了二硫键连接性预测并减少了对同源序列的要求。
Bioinformatics. 2015 Apr 15;31(8):1219-25. doi: 10.1093/bioinformatics/btu794. Epub 2014 Dec 8.
4
Dinosolve: a protein disulfide bonding prediction server using context-based features to enhance prediction accuracy.Dinosolve:一种使用基于上下文特征的蛋白质二硫键键合预测服务器,以提高预测准确性。
BMC Bioinformatics. 2013;14 Suppl 13(Suppl 13):S9. doi: 10.1186/1471-2105-14-S13-S9. Epub 2013 Oct 1.
5
On the relevance of sophisticated structural annotations for disulfide connectivity pattern prediction.关于复杂结构注释对二硫键连接模式预测的相关性。
PLoS One. 2013;8(2):e56621. doi: 10.1371/journal.pone.0056621. Epub 2013 Feb 15.
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Prediction of disulfide connectivity in proteins with machine-learning methods and correlated mutations.利用机器学习方法和相关突变预测蛋白质中二硫键的连接性。
BMC Bioinformatics. 2013;14 Suppl 1(Suppl 1):S10. doi: 10.1186/1471-2105-14-S1-S10. Epub 2013 Jan 14.
7
Inter- and intra-chain disulfide bond prediction based on optimal feature selection.基于最优特征选择的链间和链内二硫键预测
Protein Pept Lett. 2013 Mar;20(3):324-35. doi: 10.2174/0929866511320030011.
8
Improving the prediction of disulfide bonds in Eukaryotes with machine learning methods and protein subcellular localization.用机器学习方法和蛋白质亚细胞定位改进真核生物中二硫键的预测。
Bioinformatics. 2011 Aug 15;27(16):2224-30. doi: 10.1093/bioinformatics/btr387. Epub 2011 Jun 29.
9
DBCP: a web server for disulfide bonding connectivity pattern prediction without the prior knowledge of the bonding state of cysteines.DBCP:一种无需事先了解半胱氨酸键合状态的二硫键连接模式预测的网络服务器。
Nucleic Acids Res. 2010 Jul;38(Web Server issue):W503-7. doi: 10.1093/nar/gkq514. Epub 2010 Jun 8.
10
Improving the accuracy of predicting disulfide connectivity by feature selection.通过特征选择提高预测二硫键连接的准确性。
J Comput Chem. 2010 May;31(7):1478-85. doi: 10.1002/jcc.21433.