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Computational Approaches to Predict the Non-canonical DNAs

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TLDR
This study reviews the currently available computational methods for predicting the non-canonical DNAs in the genome and reviews strategies for the identification of ncDNA motifs across the whole genome, necessary for further understanding and investigation of the structure and function of nCDNAs.
Abstract
\n\nAlthough most nucleotides in the genome form canonical double-stranded\nB-DNA, many repeated sequences transiently present as non-canonical conformations (non-B\nDNA) such as triplexes, quadruplexes, Z-DNA, cruciforms, and slipped/hairpins. Those noncanonical\nDNAs (ncDNAs) are not only associated with many genetic events such as replication,\ntranscription, and recombination, but are also related to the genetic instability that results in the\npredisposition to disease. Due to the crucial roles of ncDNAs in cellular and genetic functions,\nvarious computational methods have been implemented to predict sequence motifs that generate\nncDNA.\n\n\n\nHere, we review strategies for the identification of ncDNA motifs across the whole\ngenome, which is necessary for further understanding and investigation of the structure and\nfunction of ncDNAs.\n\n\n\nThere is a great demand for computational prediction of non-canonical DNAs that\nplay key functional roles in gene expression and genome biology. In this study, we review the\ncurrently available computational methods for predicting the non-canonical DNAs in the genome.\nCurrent studies not only provide an insight into the computational methods for predicting the\nsecondary structures of DNA but also increase our understanding of the roles of non-canonical\nDNA in the genome.\n

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Citations
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Unraveling the Regulatory G-Quadruplex Puzzle: Lessons From Genome and Transcriptome-Wide Studies.

TL;DR: Individual gene studies with high-throughput differential expression studies are compared to highlight the importance of formulating a combined approach that can be applied in humans, bacteria, and viruses to better understand the effect of G4-mediated gene regulation.
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Molecular Packing Interaction in DNA Crystals

TL;DR: In this paper, the packing interaction and other factors have a strong influence on the quality of DNA crystals and provide key information to predict crystal growth of candidate oligonucleotides.
Journal ArticleDOI

An updated overview of experimental and computational approaches to identify non-canonical DNA/RNA structures with emphasis on G-quadruplexes and R-loops

TL;DR: An updated overview of conformation, current sequencing technologies and computational identification methods for non-canonical nucleic acid structures, as well as their strengths and weaknesses is provided to aid in understanding how these structures are characterised and how they contribute to related biological processes and diseases.
Journal ArticleDOI

MD-TSPC4: Computational Method for Predicting the Thermal Stability of I-Motif.

TL;DR: In this article, the authors developed a method to predict the thermal stability of i-motifs based on molecular modeling and molecular dynamic simulation, and evaluated the correlation between the root mean square deviations (RMSDs) of model structures and thermal stability as the experimentally obtained melting temperature.
References
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Journal ArticleDOI

Molecular structure of a left-handed double helical DNA fragment at atomic resolution

TL;DR: The DNA fragment d(CpGpCpC pGp CpG pG) crystallises as a left-handed double helical molecule with Watson–Crick base pairs and an antiparallel organisation of the sugar phosphate chains.
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Human c-myc onc gene is located on the region of chromosome 8 that is translocated in Burkitt lymphoma cells

TL;DR: Using a DNA probe that is specific for the complete gene (c-myc), different somatic cell hybrids possessing varying numbers of human chromosomes were analyzed by the Southern blotting technique and results indicate that the human c- myc gene is located on chromosome 8.
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Formation of parallel four-stranded complexes by guanine-rich motifs in DNA and its implications for meiosis

TL;DR: It is speculated that this self-recognition of guanine-rich motifs of DNA serves to bring together, and to zipper up in register, the four homologous chromatids during meiosis.
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Prevalence of quadruplexes in the human genome

TL;DR: There is a significant repression of quadruplexes in the coding strand of exonic regions, which suggests that quadruplex-forming patterns are disfavoured in sequences that will form RNA.
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Circular dichroism and conformational polymorphism of DNA

TL;DR: Here the authors review studies that provided important information about conformational properties of DNA using circular dichroic (CD) spectroscopy, which significantly participated in all basic conformational findings on DNA.