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DOI: 10.4230/LIPIcs.ISAAC.2021.40

Algorithms for Normalized Multiple Sequence Alignments

Authors: Eloi Araujo, Luiz C. Rozante, Diego P. Rubert, and Fábio V. Martinez

Published in: LIPIcs, Volume 212, 32nd International Symposium on Algorithms and Computation (ISAAC 2021)

Abstract

Sequence alignment supports numerous tasks in bioinformatics, natural language processing, pattern recognition, social sciences, and other fields. While the alignment of two sequences may be performed swiftly in many applications, the simultaneous alignment of multiple sequences proved to be naturally more intricate. Although most multiple sequence alignment (MSA) formulations are NP-hard, several approaches have been developed, as they can outperform pairwise alignment methods or are necessary for some applications. Taking into account not only similarities but also the lengths of the compared sequences (i.e. normalization) can provide better alignment results than both unnormalized or post-normalized approaches. While some normalized methods have been developed for pairwise sequence alignment, none have been proposed for MSA. This work is a first effort towards the development of normalized methods for MSA. We discuss multiple aspects of normalized multiple sequence alignment (NMSA). We define three new criteria for computing normalized scores when aligning multiple sequences, showing the NP-hardness and exact algorithms for solving the NMSA using those criteria. In addition, we provide approximation algorithms for MSA and NMSA for some classes of scoring matrices.

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Eloi Araujo, Luiz C. Rozante, Diego P. Rubert, and Fábio V. Martinez. Algorithms for Normalized Multiple Sequence Alignments. In 32nd International Symposium on Algorithms and Computation (ISAAC 2021). Leibniz International Proceedings in Informatics (LIPIcs), Volume 212, pp. 40:1-40:16, Schloss Dagstuhl – Leibniz-Zentrum für Informatik (2021)

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@InProceedings{araujo_et_al:LIPIcs.ISAAC.2021.40,
  author =	{Araujo, Eloi and Rozante, Luiz C. and Rubert, Diego P. and Martinez, F\'{a}bio V.},
  title =	{{Algorithms for Normalized Multiple Sequence Alignments}},
  booktitle =	{32nd International Symposium on Algorithms and Computation (ISAAC 2021)},
  pages =	{40:1--40:16},
  series =	{Leibniz International Proceedings in Informatics (LIPIcs)},
  ISBN =	{978-3-95977-214-3},
  ISSN =	{1868-8969},
  year =	{2021},
  volume =	{212},
  editor =	{Ahn, Hee-Kap and Sadakane, Kunihiko},
  publisher =	{Schloss Dagstuhl -- Leibniz-Zentrum f{\"u}r Informatik},
  address =	{Dagstuhl, Germany},
  URL =		{https://drops-dev.dagstuhl.de/entities/document/10.4230/LIPIcs.ISAAC.2021.40},
  URN =		{urn:nbn:de:0030-drops-154734},
  doi =		{10.4230/LIPIcs.ISAAC.2021.40},
  annote =	{Keywords: Multiple sequence alignment, Normalized multiple sequence alignment, Algorithms and complexity}
}

Document

DOI: 10.4230/LIPIcs.WABI.2020.3

Natural Family-Free Genomic Distance

Authors: Diego P. Rubert, Fábio V. Martinez, and Marília D. V. Braga

Published in: LIPIcs, Volume 172, 20th International Workshop on Algorithms in Bioinformatics (WABI 2020)

Abstract

A classical problem in comparative genomics is to compute the rearrangement distance, that is the minimum number of large-scale rearrangements required to transform a given genome into another given genome. While the most traditional approaches in this area are family-based, i.e., require the classification of DNA fragments of both genomes into families, more recently an alternative model was proposed, which, instead of family classification, simply uses the pairwise similarities between DNA fragments of both genomes to compute their rearrangement distance. This model represents structural rearrangements by the generic double cut and join (DCJ) operation and is then called family-free DCJ distance. It computes the DCJ distance between the two genomes by searching for a matching of their genes based on the given pairwise similarities, therefore helping to find gene homologies. The drawback is that its computation is NP-hard. Another point is that the family-free DCJ distance must correspond to a maximal matching of the genes, due to the fact that unmatched genes are just ignored: maximizing the matching prevents the free lunch artifact of having empty or almost empty matchings giving the smaller distances. In this paper, besides DCJ operations, we allow content-modifying operations of insertions and deletions of DNA segments and propose a new and more general family-free genomic distance. In our model we use the pairwise similarities to assign weights to both matched and unmatched genes, so that an optimal solution does not necessarily maximize the matching. Our model then results in a natural family-free genomic distance, that takes into consideration all given genes and has a search space composed of matchings of any size. We provide an efficient ILP formulation to solve it, by extending the previous formulations for computing family-based genomic distances from Shao et al. (J. Comput. Biol., 2015) and Bohnenkämper et al. (Proc. of RECOMB, 2020). Our experiments show that the ILP can handle not only bacterial genomes, but also fungi and insects, or sets of chromosomes of mammals and plants. In a comparison study of six fruit fly genomes, we obtained accurate results.

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Diego P. Rubert, Fábio V. Martinez, and Marília D. V. Braga. Natural Family-Free Genomic Distance. In 20th International Workshop on Algorithms in Bioinformatics (WABI 2020). Leibniz International Proceedings in Informatics (LIPIcs), Volume 172, pp. 3:1-3:23, Schloss Dagstuhl – Leibniz-Zentrum für Informatik (2020)

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@InProceedings{rubert_et_al:LIPIcs.WABI.2020.3,
  author =	{Rubert, Diego P. and Martinez, F\'{a}bio V. and Braga, Mar{\'\i}lia D. V.},
  title =	{{Natural Family-Free Genomic Distance}},
  booktitle =	{20th International Workshop on Algorithms in Bioinformatics (WABI 2020)},
  pages =	{3:1--3:23},
  series =	{Leibniz International Proceedings in Informatics (LIPIcs)},
  ISBN =	{978-3-95977-161-0},
  ISSN =	{1868-8969},
  year =	{2020},
  volume =	{172},
  editor =	{Kingsford, Carl and Pisanti, Nadia},
  publisher =	{Schloss Dagstuhl -- Leibniz-Zentrum f{\"u}r Informatik},
  address =	{Dagstuhl, Germany},
  URL =		{https://drops-dev.dagstuhl.de/entities/document/10.4230/LIPIcs.WABI.2020.3},
  URN =		{urn:nbn:de:0030-drops-127926},
  doi =		{10.4230/LIPIcs.WABI.2020.3},
  annote =	{Keywords: Comparative genomics, Genome rearrangement, DCJ-indel distance}
}

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Documents authored by Martinez, Fábio V.

Algorithms for Normalized Multiple Sequence Alignments

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Natural Family-Free Genomic Distance

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