BSAlign:核苷酸序列比对库。

Haojing Shao, Jue Ruan
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引用次数: 0

摘要

提高核苷酸序列比对的准确性是基因组学研究中的一个重要问题。虽然经典的动态编程(DP)算法(如 Smith-Waterman 和 Needleman-Wunsch)能保证产生最优结果,但其时间复杂性阻碍了大规模序列比对的应用。许多旨在加速序列比对过程的优化方法一般来自三个方面:重新设计数据结构[如对角线式或条带式单指令多数据(SIMD)实现]、增加 SIMD 操作的并行次数(如差分递推关系)或缩小搜索空间(如带状 DP)。然而,还没有一种方法能将这三个方面结合起来,从而建立一种超快算法。在这项研究中,我们开发了带状条带对齐器(BSAlign)库,通过将一系列新方法编织在一起,利用上述三个方面的优势,如带状矢量化中的主动 F 循环和带状 DP 中的带状移动,以超高速提供精确的对齐结果。我们将新的加速设计应用于常规配对和编辑距离配对。与其他基于 SIMD 的实现相比,BSAlign 的常规配对速度提高了 2 倍,在基于编辑距离的实现中,BSAlign 的长读取速度提高了 1.5 倍到 4 倍。BSAlign 是用 C 语言实现的,可在 https://github.com/ruanjue/bsalign 上查阅。
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BSAlign: A Library for Nucleotide Sequence Alignment.

Increasing the accuracy of the nucleotide sequence alignment is an essential issue in genomics research. Although classic dynamic programming (DP) algorithms (e.g., Smith-Waterman and Needleman-Wunsch) guarantee to produce the optimal result, their time complexity hinders the application of large-scale sequence alignment. Many optimization efforts that aim to accelerate the alignment process generally come from three perspectives: redesigning data structures [e.g., diagonal or striped Single Instruction Multiple Data (SIMD) implementations], increasing the number of parallelisms in SIMD operations (e.g., difference recurrence relation), or reducing search space (e.g., banded DP). However, no methods combine all these three aspects to build an ultra-fast algorithm. In this study, we developed a Banded Striped Aligner (BSAlign) library that delivers accurate alignment results at an ultra-fast speed by knitting a series of novel methods together to take advantage of all of the aforementioned three perspectives with highlights such as active F-loop in striped vectorization and striped move in banded DP. We applied our new acceleration design on both regular and edit distance pairwise alignment. BSAlign achieved 2-fold speed-up than other SIMD-based implementations for regular pairwise alignment, and 1.5-fold to 4-fold speed-up in edit distance-based implementations for long reads. BSAlign is implemented in C programing language and is available at https://github.com/ruanjue/bsalign.

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