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I-TASSER server: new development for protein structure and function predictions

机译:I-TASSER服务器:蛋白质结构和功能预测的新发展

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摘要

The I-TASSER server () is an online resource for automated protein structure prediction and structure-based function annotation. In I-TASSER, structural templates are first recognized from the PDB using multiple threading alignment approaches. Full-length structure models are then constructed by iterative fragment assembly simulations. The functional insights are finally derived by matching the predicted structure models with known proteins in the function databases. Although the server has been widely used for various biological and biomedical investigations, numerous comments and suggestions have been reported from the user community. In this article, we summarize recent developments on the I-TASSER server, which were designed to address the requirements from the user community and to increase the accuracy of modeling predictions. Focuses have been made on the introduction of new methods for atomic-level structure refinement, local structure quality estimation and biological function annotations. We expect that these new developments will improve the quality of the I-TASSER server and further facilitate its use by the community for high-resolution structure and function prediction.
机译:I-TASSER服务器()是用于自动化蛋白质结构预测和基于结构的功能注释的在线资源。在I-TASSER中,首先使用多线程对齐方法从PDB识别结构模板。然后,通过迭代片段装配模拟来构建全长结构模型。通过将预测的结构模型与功能数据库中的已知蛋白质进行匹配,最终得出功能见解。尽管服务器已广泛用于各种生物学和生物医学研究,但用户社区已报告了许多评论和建议。在本文中,我们总结了I-TASSER服务器上的最新开发,旨在满足用户社区的需求并提高建模预测的准确性。重点已放在引入用于原子级结构细化,局部结构质量估计和生物功能注释的新方法上。我们希望这些新的发展将提高I-TASSER服务器的质量,并进一步促进社区对其进行高分辨率结构和功能预测的使用。

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