Applications of Symmetry in Computational Biology

A special issue of Symmetry (ISSN 2073-8994). This special issue belongs to the section "Life Sciences".

Deadline for manuscript submissions: 31 July 2025 | Viewed by 5715

Special Issue Editors


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Guest Editor
1. Department of Computational Biology, Cornell University, Ithaca, NY 14853, USA
2. Weill Institute for Cell and Molecular Biology, Cornell University, Ithaca, NY 14853, USA
Interests: computational biology; machine learning; bioinformatics

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Guest Editor
1. Program in Medical and Population Genetics, Broad Institute of MIT and Harvard, Cambridge, MA, USA
2. Analytic and Translational Genetics Unit, Massachusetts General Hospital, Boston, MA, USA
Interests: bioinformatics; disease association; translational research; omics data; genetics and genomics
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Special Issue Information

Dear Colleagues,

In this Special Issue of Symmetry, we delve into the intricate role symmetry plays within the field of computational biology. Symmetry, a recurring theme in biological structures and processes, provides a unique perspective through which computational biological techniques can be applied to study a variety of biological problems. This issue aims to showcase innovative research where symmetry principles are applied to solve complex biological problems, ranging from molecular simulations to system-level analyses. The convergence of computational power and symmetrical models has the potential to unlock new understandings in areas such as macromolecular structures, genetic networks, mathematical biology, developmental biology, and evolution. Through original research articles as well as review articles, we invite contributors to explore the transformative impact of symmetry in computational biology research, fostering a deeper comprehension of life's underlying patterns and processes.

We are looking for submissions that cover a wide range of topics at the intersection of symmetry and computational biology, including but not limited to:

  • Computational studies of macromolecular structures (protein, RNA, etc.) involving structural symmetry or asymmetry;
  • Computational methods for molecular drug discovery leveraging the symmetry of molecules and transition states;
  • Genomic symmetry and asymmetry in gene regulation and genome evolution;
  • Symmetry-based modeling of the development and evolution of biological systems, such as the organization of cellular structures and the development of organisms;
  • Application of group theory in molecular and cellular network dynamics;
  • Symmetrical structures in biological neural networks and their relationship to functional connectivity and brain functions;
  • Synthetic engineering of symmetrical biological circuits and systems to create robust biological functions.

Dr. Siqi Liang
Dr. Siwei Chen
Guest Editors

Manuscript Submission Information

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Submitted manuscripts should not have been published previously, nor be under consideration for publication elsewhere (except conference proceedings papers). All manuscripts are thoroughly refereed through a single-blind peer-review process. A guide for authors and other relevant information for submission of manuscripts is available on the Instructions for Authors page. Symmetry is an international peer-reviewed open access monthly journal published by MDPI.

Please visit the Instructions for Authors page before submitting a manuscript. The Article Processing Charge (APC) for publication in this open access journal is 2400 CHF (Swiss Francs). Submitted papers should be well formatted and use good English. Authors may use MDPI's English editing service prior to publication or during author revisions.

Keywords

  • symmetry
  • asymmetry
  • computational biology
  • macromolecular structure
  • drug discovery
  • genomics
  • developmental biology
  • group theory
  • network dynamics
  • computational neuroscience
  • synthetic biology

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Published Papers (4 papers)

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Research

16 pages, 2216 KiB  
Article
Mirror Complementary Triplet Periodicity of Dispersed Repeats in Bacterial Genomes
by Eugene Vadimovitch Korotkov
Symmetry 2025, 17(4), 549; https://doi.org/10.3390/sym17040549 - 3 Apr 2025
Viewed by 277
Abstract
We investigated overlapping dispersed repeats (DRs) on the plus and minus DNA strands in 12 bacterial genomes. The use of the iterative procedure method (IP method) without taking into account insertions or deletions of nucleotides allowed speeding up the calculations by several times [...] Read more.
We investigated overlapping dispersed repeats (DRs) on the plus and minus DNA strands in 12 bacterial genomes. The use of the iterative procedure method (IP method) without taking into account insertions or deletions of nucleotides allowed speeding up the calculations by several times and increased the number of the identified DRs by 10–20%. Most of the DRs were found in the known bacterial genes. The intersection regions of the bacterial DRs contained reverse complement codons. Calculation of triplet periodicity matrices mt(i,j) (i is the position in the codon and j is the nucleotide) was performed for the intersection regions. Two classes of matrices in which the number of nucleotides was significantly greater than in random sequences were revealed: the first contained mt(1,G), mt(2,A), mt(2,T), and mt(3,C) cells and the second mt(1,G), mt(2,C), mt(3,A), and mt(3,T) cells. These classes included 10 and 2 bacterial genomes, respectively. The reverse complement transformation of the DR intersection regions preserved the cells in both classes, although cyclic matrix shifting to the right by one base was observed in the second class. The reverse complement codons in the DR intersection regions on the plus and minus DNA strands could represent sites of more frequent inversions/transpositions or participate in the formation of secondary/tertiary mRNA structures. Full article
(This article belongs to the Special Issue Applications of Symmetry in Computational Biology)
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19 pages, 3485 KiB  
Article
Predicting the Distribution of Ailanthus altissima Using Deep Learning-Based Analysis of Satellite Imagery
by Ruohan Gao, Zipeng Song, Junhan Zhao and Yingnan Li
Symmetry 2025, 17(3), 324; https://doi.org/10.3390/sym17030324 - 21 Feb 2025
Viewed by 531
Abstract
Invasive species negatively affect ecosystems, economies, and human health by outcompeting native species and altering habitats. Ailanthus altissima, also known as the tree of heaven, an invasive species native to China that has spread to North America and Europe. Commonly found in [...] Read more.
Invasive species negatively affect ecosystems, economies, and human health by outcompeting native species and altering habitats. Ailanthus altissima, also known as the tree of heaven, an invasive species native to China that has spread to North America and Europe. Commonly found in urban areas and forestland, these invasive plants cause ecological and economic damage to local ecosystems; they are also the preferred host of other invasive species. Ecological stability refers to the balance and harmony in species populations. Invasive species like A. altissima disrupt this stability by outcompeting native species, leading to imbalances, and there was a lack of research and data on the tree of heaven. To address this issue, this study leveraged deep learning and satellite imagery recognition to generate reliable and comprehensive prediction maps in the USA. Four deep learning models were trained to recognize satellite images obtained from Google Earth, with A. altissima data obtained from the Life Alta Murgia project, LIFE12 BIO/IT/000213. The best performing fine-tuned model using binary classification achieved an AUC score of 90%. This model was saved locally and used to predict the density and probability of A. altissima in the USA. Additionally, multi-class classification methods corroborated the findings, demonstrating similar observational outcomes. The production of these predictive distribution maps is a novel method which offers an innovative and cost-effective alternative for extensive field surveys, providing reliable data for concurrent and future research on the environmental impact of A. altissima. Full article
(This article belongs to the Special Issue Applications of Symmetry in Computational Biology)
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17 pages, 382 KiB  
Article
Novel Algorithm for Comparing Phylogenetic Trees with Different but Overlapping Taxa
by Aleksandr Koshkarov and Nadia Tahiri
Symmetry 2024, 16(7), 790; https://doi.org/10.3390/sym16070790 - 24 Jun 2024
Cited by 2 | Viewed by 1793
Abstract
Comparing phylogenetic trees is a prominent problem widely used in applications such as clustering and building the Tree of Life. While there are many well-developed distance measures for phylogenetic trees defined on the same set of taxa, the situation is contrasting for trees [...] Read more.
Comparing phylogenetic trees is a prominent problem widely used in applications such as clustering and building the Tree of Life. While there are many well-developed distance measures for phylogenetic trees defined on the same set of taxa, the situation is contrasting for trees defined on different but mutually overlapping sets of taxa. This paper presents a new polynomial-time algorithm for completing phylogenetic trees and computing the distance between trees defined on different but overlapping sets of taxa. This novel approach considers both the branch lengths and the topology of the phylogenetic trees being compared. We demonstrate that the distance measure applied to completed trees is a metric and provide several properties of the new method, including its symmetrical nature in tree completion. Full article
(This article belongs to the Special Issue Applications of Symmetry in Computational Biology)
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15 pages, 3212 KiB  
Article
UniproLcad: Accurate Identification of Antimicrobial Peptide by Fusing Multiple Pre-Trained Protein Language Models
by Xiao Wang, Zhou Wu, Rong Wang and Xu Gao
Symmetry 2024, 16(4), 464; https://doi.org/10.3390/sym16040464 - 11 Apr 2024
Cited by 6 | Viewed by 2486
Abstract
Antimicrobial peptides (AMPs) are vital components of innate immunotherapy. Existing approaches mainly rely on either deep learning for the automatic extraction of sequence features or traditional manual amino acid features combined with machine learning. The peptide sequence contains symmetrical sequence motifs or repetitive [...] Read more.
Antimicrobial peptides (AMPs) are vital components of innate immunotherapy. Existing approaches mainly rely on either deep learning for the automatic extraction of sequence features or traditional manual amino acid features combined with machine learning. The peptide sequence contains symmetrical sequence motifs or repetitive amino acid patterns, which may be related to the function and structure of the peptide. Recently, the advent of large language models has significantly boosted the representational power of sequence pattern features. In light of this, we present a novel AMP predictor called UniproLcad, which integrates three prominent protein language models—ESM-2, ProtBert, and UniRep—to obtain a more comprehensive representation of protein features. UniproLcad utilizes deep learning networks, encompassing the bidirectional long and short memory network (Bi-LSTM) and one-dimensional convolutional neural networks (1D-CNN), while also integrating an attention mechanism to enhance its capabilities. These deep learning frameworks, coupled with pre-trained language models, efficiently extract multi-view features from antimicrobial peptide sequences and assign attention weights to them. Through ten-fold cross-validation and independent testing, UniproLcad demonstrates competitive performance in the field of antimicrobial peptide identification. This integration of diverse language models and deep learning architectures enhances the accuracy and reliability of predicting antimicrobial peptides, contributing to the advancement of computational methods in this field. Full article
(This article belongs to the Special Issue Applications of Symmetry in Computational Biology)
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