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Prediction of RNA secondary structure with pseudoknots using integer programming

机译:使用整数编程预测伪通知的RNA二级结构

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Background: RNA secondary structure prediction is one major task in bioinformatics, and various computational methods have been proposed so far. Pseudoknot is one of the typical substructures appearing in several RNAs, and plays an important role in some biological processes. Prediction of RNA secondary structure with pseudoknots is still challenging since the problem is NP-hard when arbitrary pseudoknots are taken into consideration.Results: We introduce a new method of predicting RNA secondary structure with pseudoknots based on integer programming. In our formulation, we aim at minimizing the value of the objective function that reflects free energy of a folding structure of an input RNA sequence. We focus on a practical class of pseudoknots by setting constraints appropriately.Experimental results for a set of real RNA sequences show that our proposed method outperforms several existing methods in sensitivity. Furthermore, for a set of sequences of small length, our approach achieved good performance in both sensitivity and specificity.Conclusions: Our integer programming-based approach for RNA structure prediction is flexible and extensible.
机译:背景:RNA二级结构预测是生物信息学中的一个主要任务,到目前为止已经提出了各种计算方法。 Pseudoknot是在几个RNA中出现的典型子结构之一,在一些生物过程中起着重要作用。当考虑任意伪通知时,当问题是NP - 硬质时,伪通知的RNA二级结构的预测仍然具有挑战性。结果:我们介绍了一种基于整数规划的伪通知预测RNA二级结构的新方法。在我们的配方中,我们的目标是最小化反映输入RNA序列的折叠结构的自由能的目标函数的值。我们通过适当地设定约束来专注于实际类伪影。一组真实RNA序列的实验结果表明,我们提出的方法优于敏感性的几种现有方法。此外,对于一组小长度的序列,我们的方法在敏感性和特异性方面取得了良好的性能。结论:我们的整数基于编程的RNA结构预测方法是灵活且可伸缩的。

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