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从蛋白质序列预测二级和超二级结构的计算方法的最新进展

Recent Advances in Computational Prediction of Secondary and Supersecondary Structures from Protein Sequences.

作者信息

Zhang Jian, Qian Jingjing, Zou Quan, Zhou Feng, Kurgan Lukasz

机构信息

School of Computer and Information Technology, Xinyang Normal University, Xinyang, China.

Yangtze Delta Region Institute (Quzhou), University of Electronic Science and Technology of China, Quzhou, China.

出版信息

Methods Mol Biol. 2025;2870:1-19. doi: 10.1007/978-1-0716-4213-9_1.

DOI:10.1007/978-1-0716-4213-9_1
PMID:39543027
Abstract

The secondary structures (SSs) and supersecondary structures (SSSs) underlie the three-dimensional structure of proteins. Prediction of the SSs and SSSs from protein sequences enjoys high levels of use and finds numerous applications in the development of a broad range of other bioinformatics tools. Numerous sequence-based predictors of SS and SSS were developed and published in recent years. We survey and analyze 45 SS predictors that were released since 2018, focusing on their inputs, predictive models, scope of their prediction, and availability. We also review 32 sequence-based SSS predictors, which primarily focus on predicting coiled coils and beta-hairpins and which include five methods that were published since 2018. Substantial majority of these predictive tools rely on machine learning models, including a variety of deep neural network architectures. They also frequently use evolutionary sequence profiles. We discuss details of several modern SS and SSS predictors that are currently available to the users and which were published in higher impact venues.

摘要

二级结构(SSs)和超二级结构(SSSs)构成了蛋白质的三维结构。从蛋白质序列预测SSs和SSSs的方法得到了广泛应用,并在众多其他生物信息学工具的开发中有着大量应用。近年来,人们开发并发表了许多基于序列的SS和SSS预测器。我们调查并分析了自2018年以来发布的45个SS预测器,重点关注它们的输入、预测模型、预测范围和可用性。我们还回顾了32个基于序列的SSS预测器,这些预测器主要侧重于预测卷曲螺旋和β-发夹结构,其中包括2018年以来发表的五种方法。这些预测工具绝大多数依赖机器学习模型,包括各种深度神经网络架构。它们还经常使用进化序列概况。我们讨论了目前用户可以使用的、发表在影响力较大的期刊上的几种现代SS和SSS预测器的细节。

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Tutorial: a guide for the selection of fast and accurate computational tools for the prediction of intrinsic disorder in proteins.教程:用于选择快速准确的计算工具预测蛋白质内无序性的指南。
Nat Protoc. 2023 Nov;18(11):3157-3172. doi: 10.1038/s41596-023-00876-x. Epub 2023 Sep 22.
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WG-ICRN: Protein 8-state secondary structure prediction based on Wasserstein generative adversarial networks and residual networks with Inception modules.WG-ICRN:基于 Wasserstein 生成对抗网络和带有 Inception 模块的残差网络的 8 态蛋白质二级结构预测。
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Twenty years of advances in prediction of nucleic acid-binding residues in protein sequences.
蛋白质序列中核酸结合残基预测二十年进展
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Protein secondary structure prediction based on Wasserstein generative adversarial networks and temporal convolutional networks with convolutional block attention modules.
基于瓦瑟斯坦生成对抗网络、带有卷积块注意力模块的时间卷积网络的蛋白质二级结构预测
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DeepPRObind: Modular Deep Learner that Accurately Predicts Structure and Disorder-Annotated Protein Binding Residues.DeepPRObind:精确预测具有结构和无序注释的蛋白质结合残基的模块化深度学习模型
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Deep learning for protein secondary structure prediction: Pre and post-AlphaFold.用于蛋白质二级结构预测的深度学习:AlphaFold之前与之后。
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