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	<title><![CDATA[BOL: Related items]]></title>
	<link>https://bioinformaticsonline.com/related/43364?offset=60</link>
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	<description><![CDATA[]]></description>
	
	<item>
	<guid isPermaLink="true">https://bioinformaticsonline.com/pages/view/44377/mitochondrial-genome-assembly-tools</guid>
	<pubDate>Wed, 06 Sep 2023 00:37:18 -0500</pubDate>
	<link>https://bioinformaticsonline.com/pages/view/44377/mitochondrial-genome-assembly-tools</link>
	<title><![CDATA[Mitochondrial genome assembly tools !]]></title>
	<description><![CDATA[<p>Mitochondrial genome assembly tools are specialized software and algorithms designed to accurately reconstruct the mitochondrial genome (mitogenome) from sequencing data, typically obtained through techniques like next-generation sequencing (NGS). The mitochondrial genome is relatively small compared to the nuclear genome, making it an ideal target for assembly. Here are some commonly used mitochondrial genome assembly tools:</p><p><strong>MitoFinder:</strong> Mitofinder is a pipeline to assemble mitochondrial genomes and annotate mitochondrial genes from trimmed read sequencing data.</p><p><strong>MitoHiFi:</strong> a python pipeline for mitochondrial genome assembly from PacBio high fidelity reads</p><p>MITObim: MITObim is a tool specifically developed for the iterative assembly of mitochondrial genomes. It starts with a reference mitogenome and iteratively refines the assembly using the read data.</p><p><strong>MITOS:</strong> MITOS is a web-based platform that provides a pipeline for annotating mitochondrial genomes. It integrates multiple software tools for assembly, annotation, and visualization of mitogenomes.</p><p><strong>MIRA:</strong> MIRA (Mimicking Intelligent Read Assembly) is a versatile genome assembly tool that can be used for mitochondrial genome assembly. It supports various sequencing technologies and allows for reference-based or de novo assembly.</p><p><strong>NOVOPlasty:</strong> NOVOPlasty is a user-friendly tool designed for de novo assembly of organelle genomes, including mitochondria. It utilizes a seed-and-extend algorithm and is suitable for both short-read and long-read data.</p><p><strong>MITOS2:</strong> MITOS2 is an updated version of the MITOS pipeline, which automates the annotation of mitochondrial genomes. It provides improved accuracy and additional features for mitochondrial genome analysis.</p><p><strong>GetOrganelle:</strong> While primarily designed for chloroplast genome assembly, GetOrganelle can also be used for mitochondrial genome assembly. It is particularly useful for dealing with high-throughput sequencing data.</p><p><strong>SPAdes:</strong> SPAdes (St. Petersburg genome assembler) is a versatile genome assembly tool that can be employed for mitochondrial genome assembly, especially when dealing with complex datasets that may contain nuclear mitochondrial DNA sequences (numts).</p><p><strong>IDBA-UD:</strong> IDBA-UD (Iterative De Bruijn Graph De Novo Assembler) is another de novo assembly tool that can be used for mitochondrial genome assembly, especially in cases with relatively low coverage.</p><p><strong>Velvet:</strong> Velvet is a de novo assembly tool that can be applied to mitochondrial genome assembly, especially when working with short-read data.</p><p>When selecting a mitochondrial genome assembly tool, it's important to consider the specific characteristics of your sequencing data, such as read length and coverage, as well as the complexity of the mitochondrial genome. Additionally, some tools are better suited for specific organisms or research objectives, so choosing the right tool will depend on your particular project requirements.</p>]]></description>
	<dc:creator>Abhi</dc:creator>
</item>
<item>
	<guid isPermaLink="true">https://bioinformaticsonline.com/bookmarks/view/30236/pyscaf</guid>
	<pubDate>Mon, 19 Dec 2016 14:20:33 -0600</pubDate>
	<link>https://bioinformaticsonline.com/bookmarks/view/30236/pyscaf</link>
	<title><![CDATA[pyScaf]]></title>
	<description><![CDATA[<p>pyScaf orders contigs from genome assemblies utilising several types of information:</p>
<ul>
<li>paired-end (PE) and/or mate-pair libraries (<a href="https://github.com/lpryszcz/pyScaf#ngs-based-scaffolding">NGS-based mode</a>)</li>
<li>long reads (<a href="https://github.com/lpryszcz/pyScaf#scaffolding-based-on-long-reads">NGS-based mode</a>)</li>
<li>synteny to the genome of some related species (<a href="https://github.com/lpryszcz/pyScaf#reference-based-scaffolding">reference-based mode</a>)</li>
</ul>
<p>Scaffolding&nbsp;</p>
<p>In reference-based mode, pyScaf uses synteny to the genome of closely related species in order to order contigs and estimate distances between adjacent contigs.</p>
<p>Contigs are aligned globally (end-to-end) onto reference chromosomes, ignoring:</p>
<ul>
<li>matches not satisfying cut-offs (<code>--identity</code>&nbsp;and&nbsp;<code>--overlap</code>)</li>
<li>suboptimal matches (only best match of each query to reference is kept)</li>
<li>and removing overlapping matches on reference.</li>
</ul>
<p>In preliminary tests, pyScaf performed superbly on simulated heterozygous genomes based on&nbsp;<em>C. parapsilosis</em>&nbsp;(13 Mb; CANPA) and&nbsp;<em>A. thaliana</em>&nbsp;(119 Mb; ARATH) chromosomes, reconstructing correctly all chromosomes always for CANPA and nearly always for ARATH (<a href="https://www.dropbox.com/sh/bb7lwggo40xrwtc/AAAZ7pByVQQQ-WhUXZVeJaZVa/pyScaf?dl=0">Figures in dropbox</a>,&nbsp;<a href="https://docs.google.com/spreadsheets/d/1InBExy-qKDLj-upd8tlPItVSKc4mLepZjZxB31ii9OY/edit#gid=2036953672">CANPA table</a>,&nbsp;<a href="https://docs.google.com/spreadsheets/d/1InBExy-qKDLj-upd8tlPItVSKc4mLepZjZxB31ii9OY/edit#gid=1920757821">ARATH table</a>).<br>Runs took ~0.5 min for CANPA on&nbsp;<code>4 CPUs</code>&nbsp;and ~2 min for ARATH on&nbsp;<code>16 CPUs</code>.</p>
<p><span>Important remarks:</span></p>
<ul>
<li>Reduce your assembly before (fasta2homozygous.py) as any redundancy will likely break the synteny.</li>
<li>pyScaf works better with contigs than scaffolds, as scaffolds are often affected by mis-assemblies (no&nbsp;<em>de novo assembler</em>&nbsp;/ scaffolder is perfect...), which breaks synteny.</li>
<li>pyScaf works very well if divergence between reference genome and assembled contigs is below 20% at nucleotide level.</li>
<li>pyScaf deals with large rearrangements ie. deletions, insertion, inversions, translocations.&nbsp;<span>Note however, this is experimental implementation!</span></li>
<li>Consider closing gaps after scaffolding.</li>
</ul><p>Address of the bookmark: <a href="https://github.com/lpryszcz/pyScaf" rel="nofollow">https://github.com/lpryszcz/pyScaf</a></p>]]></description>
	<dc:creator>Bulbul</dc:creator>
</item>
<item>
	<guid isPermaLink="true">https://bioinformaticsonline.com/bookmarks/view/32481/sspace</guid>
	<pubDate>Fri, 05 May 2017 05:42:15 -0500</pubDate>
	<link>https://bioinformaticsonline.com/bookmarks/view/32481/sspace</link>
	<title><![CDATA[SSPACE]]></title>
	<description><![CDATA[<p>SSPACE standard is a stand-alone program for scaffolding pre-assembled contigs using NGS paired-read data. It is unique in offering the possibility to manually control the scaffolding process. By using the distance information of paired-end and/or matepair data, SSPACE is able to assess the order, distance and orientation of your contigs and combine them into scaffolds. Currently we offer this as a command-line tool in Perl. The input data is given by pre-assembled contig sequences (FASTA) and NGS paired-read data (Illumina/454/Solid FASTA or FASTQ). The final scaffolds are provided in FASTA format.</p>
<p>&nbsp;</p><p>Address of the bookmark: <a href="https://www.baseclear.com/genomics/bioinformatics/basetools/SSPACE" rel="nofollow">https://www.baseclear.com/genomics/bioinformatics/basetools/SSPACE</a></p>]]></description>
	<dc:creator>Jit</dc:creator>
</item>
<item>
	<guid isPermaLink="true">https://bioinformaticsonline.com/bookmarks/view/36592/lachesis-genome-assembly-with-hi-c-based-contact-probability-maps-lachesis</guid>
	<pubDate>Mon, 14 May 2018 04:26:30 -0500</pubDate>
	<link>https://bioinformaticsonline.com/bookmarks/view/36592/lachesis-genome-assembly-with-hi-c-based-contact-probability-maps-lachesis</link>
	<title><![CDATA[LACHESIS: Genome Assembly with Hi-C-based Contact Probability Maps (LACHESIS)]]></title>
	<description><![CDATA[<p>LACHESIS is method that exploits contact probability map data (e.g. from Hi-C) for chromosome-scale&nbsp;<em>de novo</em>&nbsp;genome assembly.</p>
<p>Further information about LACHESIS, including source code, documentation and a user's guide are available at:&nbsp;<a href="http://shendurelab.github.io/LACHESIS/">http://shendurelab.github.io/LACHESIS</a>.</p>
<p>Manuscript describing LACHESIS was published as: Burton JN#, Adey A, Patwardhan RP, Qiu R, Kitzman JO, Shendure J#.&nbsp;<em>Chromosome-scale scaffolding of de novo genome assemblies based on chromatin interactions.</em>&nbsp;Nature Biotechnology 2013 Dec;31(12):1119-25. doi:&nbsp;<a href="http://dx.doi.org/10.1038/nbt.2727">10.1038/nbt.272</a>. PubMed PMID:&nbsp;<a href="http://www.ncbi.nlm.nih.gov/pubmed/24185095">24185095</a>.</p>
<p>&nbsp;</p>
<p>http://shendurelab.github.io/LACHESIS/</p><p>Address of the bookmark: <a href="http://shendurelab.github.io/LACHESIS/" rel="nofollow">http://shendurelab.github.io/LACHESIS/</a></p>]]></description>
	<dc:creator>Jit</dc:creator>
</item>
<item>
	<guid isPermaLink="true">https://bioinformaticsonline.com/bookmarks/view/39269/ragoo-fast-reference-guided-scaffolding-of-genome-assembly-contigs</guid>
	<pubDate>Wed, 17 Apr 2019 19:45:22 -0500</pubDate>
	<link>https://bioinformaticsonline.com/bookmarks/view/39269/ragoo-fast-reference-guided-scaffolding-of-genome-assembly-contigs</link>
	<title><![CDATA[RaGOO: Fast Reference-Guided Scaffolding of Genome Assembly Contigs]]></title>
	<description><![CDATA[<p>Alonge M, Soyk S, Ramakrishnan S, Wang X, Goodwin S, Sedlazeck FJ, Lippman ZB, Schatz MC:&nbsp;<a href="https://www.biorxiv.org/content/early/2019/01/13/519637">Fast and accurate reference-guided scaffolding of draft genomes</a>.&nbsp;<em>bioRxiv</em>&nbsp;2019.</p>
<p>RaGOO is a tool for coalescing genome assembly contigs into pseudochromosomes via minimap2 alignments to a closely related reference genome. The focus of this tool is on practicality and therefore has the following features:</p>
<ol>
<li>Good performance. On a MacBook Pro using Arabidopsis data, pseudochromosome construction takes less than a minute and the whole pipeline with SV calling takes ~2 minutes.</li>
<li>Intact ordering and orienting of contigs.</li>
<li><a href="https://github.com/malonge/RaGOO/wiki/Breaking-Chimeric-Contigs">Chimeric contig correction</a></li>
<li><a href="https://github.com/malonge/RaGOO/wiki/GFF-File-Lift-Over">GFF lift-over</a></li>
<li><a href="https://github.com/malonge/RaGOO/wiki/Calling-Structural-Variants">Structural variant calling with and integrated version of Assemblytics</a></li>
<li>Confidence scores associated with the grouping, localization, and orientation for each contig.</li>
</ol><p>Address of the bookmark: <a href="https://github.com/malonge/RaGOO" rel="nofollow">https://github.com/malonge/RaGOO</a></p>]]></description>
	<dc:creator>BioJoker</dc:creator>
</item>
<item>
	<guid isPermaLink="true">https://bioinformaticsonline.com/bookmarks/view/44491/cgviewjs-is-a-circular-genome-viewing-tool</guid>
	<pubDate>Wed, 27 Mar 2024 11:16:24 -0500</pubDate>
	<link>https://bioinformaticsonline.com/bookmarks/view/44491/cgviewjs-is-a-circular-genome-viewing-tool</link>
	<title><![CDATA[CGView.js is a Circular Genome Viewing tool]]></title>
	<description><![CDATA[<p>CGView.js is a&nbsp;<span>C</span>ircular&nbsp;<span>G</span>enome&nbsp;<span>View</span>ing tool for visualizing and interacting with small genomes. This software is an adaptation of the Java program&nbsp;<a href="https://paulstothard.github.io/cgview/">CGView</a>.</p>
<div>
<p>CGView.js is the genome viewer of Proksee, an expert system for genome assembly, annotation and visualization.</p>
<a href="https://proksee.ca/"></a></div>
<h1 id="features">Features</h1>
<ul>
<li>
<p>Circular and linear views of genomes</p>
</li>
<li>
<p>Capable of drawing genomes up to 10 Mbp with 1000's of features and 100's contigs</p>
</li>
<li>
<p>Smooth zooming down to the sequence level</p>
</li>
<li>
<p>Easily generate features and plots directly form the sequence (e.g. ORFs, GC-content and GC-Skew)</p>
</li>
<li>
<p>Save high resolution PNG maps up to 8000x8000px</p>
</li>
<li>
<p>Fully documented API for interacting with CGView.js maps</p>
</li>
</ul><p>Address of the bookmark: <a href="https://js.cgview.ca/" rel="nofollow">https://js.cgview.ca/</a></p>]]></description>
	<dc:creator>LEGE</dc:creator>
</item>
<item>
	<guid isPermaLink="true">https://bioinformaticsonline.com/bookmarks/view/926/list-of-popular-bioinformatics-softwaretools</guid>
	<pubDate>Tue, 16 Jul 2013 14:30:30 -0500</pubDate>
	<link>https://bioinformaticsonline.com/bookmarks/view/926/list-of-popular-bioinformatics-softwaretools</link>
	<title><![CDATA[List of popular bioinformatics software/tools]]></title>
	<description><![CDATA[<p><a href="http://samtools.sourceforge.net/swlist.shtml">I</a>n current genome era, our day to day work is to handle the huge geneome sequences, expression data, several other datasets. This link provide a comprehensive list of commonly used sofware/tools.</p><p>Address of the bookmark: <a href="http://samtools.sourceforge.net/swlist.shtml" rel="nofollow">http://samtools.sourceforge.net/swlist.shtml</a></p>]]></description>
	<dc:creator>Jitendra Narayan</dc:creator>
</item>
<item>
	<guid isPermaLink="true">https://bioinformaticsonline.com/bookmarks/view/17924/software-developed-in-pevsner-lab</guid>
	<pubDate>Mon, 06 Oct 2014 12:41:26 -0500</pubDate>
	<link>https://bioinformaticsonline.com/bookmarks/view/17924/software-developed-in-pevsner-lab</link>
	<title><![CDATA[Software developed in pevsner lab]]></title>
	<description><![CDATA[<div>
<div id="block-system-main">
<div>
<div id="node-7">
<div>
<div>
<div>
<div>
<p><a href="http://pevsnerlab.kennedykrieger.org/dragon.htm">DRAGON</a>: Database Referencing of Array Genes Online</p>
<p><a href="http://pevsnerlab.kennedykrieger.org/php/node/96">SNOMAD</a>: Standardization and Normalization of Microarray Data</p>
<p><a href="http://pevsnerlab.kennedykrieger.org/php/node/70">SNPduo</a>: SNP Analysis Between Two Individuals</p>
<p><a href="http://pevsnerlab.kennedykrieger.org/php/node/71">SNPtrio</a>: Analyzing and Visualizing and Inheritance Patterns in Trios</p>
<p><a href="http://pevsnerlab.kennedykrieger.org/php/node/64">SNPscan</a>: Data Analysis and Visualization of SNP Data</p>
<p><a href="http://pevsnerlab.kennedykrieger.org/php/node/64">pediSNP</a>: Analyze SNP Data From a Pedigree of Two Generations</p>
<p><a href="http://pevsnerlab.kennedykrieger.org/php/node/73">kcoeff</a>: Calculate Cotterman Coefficients of SNP Genotype Data</p>
<p><a href="http://pevsnerlab.kennedykrieger.org/php/node/113">triPOD:</a> Detects chromosomal abnormalities in parent-child trio-based microarray data</p>
</div>
</div>
</div>
</div>
</div>
</div>
</div>
</div><p>Address of the bookmark: <a href="http://pevsnerlab.kennedykrieger.org/php/?q=software" rel="nofollow">http://pevsnerlab.kennedykrieger.org/php/?q=software</a></p>]]></description>
	<dc:creator>Robert M Willioms</dc:creator>
</item>
<item>
	<guid isPermaLink="true">https://bioinformaticsonline.com/pages/view/27459/tools-for-searching-repeats-and-palindromic-sequences</guid>
	<pubDate>Sat, 21 May 2016 22:32:25 -0500</pubDate>
	<link>https://bioinformaticsonline.com/pages/view/27459/tools-for-searching-repeats-and-palindromic-sequences</link>
	<title><![CDATA[Tools for Searching Repeats And Palindromic Sequences]]></title>
	<description><![CDATA[<p>What are genomic interspersed repeats?</p><p>In the mid 1960's scientists discovered that many genomes contain stretches of highly repetitive DNA sequences ( see Reassociation Kinetics Experiments, and C-Value Paradox ). These sequences were later characterized and placed into five categories:</p><p><strong>Simple Repeats</strong> - Duplications of simple sets of DNA bases (typically 1-5bp) such as A, CA, CGG etc.<br /><strong>Tandem Repeats</strong> - Typically found at the centromeres and telomeres of chromosomes these are duplications of more complex 100-200 base sequences.<br /><strong>Segmental Duplications</strong> - Large blocks of 10-300 kilobases which are that have been copied to another region of the genome.<br /><strong>Interspersed Repeats</strong><br />Processed Pseudogenes, Retrotranscripts, SINES - Non-functional copies of RNA genes which have been reintegrated into the genome with the assitance of a reverse transcriptase.<br />DNA Transposons<br />Retrovirus Retrotransposons<br />Non-Retrovirus Retrotransposons ( LINES )</p><p>Currently up to 50% of the human genome is repetitive in nature and as improvements are made in detection methods this number is expected to increase.</p><p>On the other hand; In genetics, the term palindrome refers to a sequence of nucleotides along a DNA (deoxyribonucleic acid) or RNA (ribonucleic acid) strand that contains the same series of nitrogenous bases regardless from which direction the strand is analyzed. Akin to a language palindrome&mdash;wherein a word or phrase is spelled the same left-to-right as right-to-left (e.g., the word RADAR or the phrase "able was I ere I saw elba")&mdash;with genetic palindromes it does not matter whether the nucleic acid strand is read starting from the 3' (three prime) end or the 5' (five prime) end of the strand.</p><p>Recent research on palindromes centers on understanding palindrome formation during gene amplification. Other studies have attempted to relate palindrome formation to molecular mechanisms involved in double stranded breaks and in the formation of inverted repeats. Assisted by high speed computers, other groups of scientists link palindrome formation to the conservation of genetic information.</p><p>Related to the direction of transcription by RNA polymerase, DNA strands have upstream and downstream terminus defined by differing chemical groups at each end. The ends of each strand of DNA or RNA are termed the 5' (phosphate bound to the 5' position carbon) and 3' (phosphate bound to the 3' carbon) ends to indicate a polarity within the molecule. Using the letters A, T, C, G, to represent the nitrogenous bases adenine, thymine, cytosine, and guanine found in DNA, and the letters A, U, C, G to represent the nitrogenous bases adenine, uracil, cytosine, guanine found in RNA (Note that uracil in RNA replaces the thymine found in DNA), geneticists usually represent DNA by a series of base codes (e.g., 5' AATCGGATTGCA 3'). The base codes are usually arranged from the 5' end to the 3' end.</p><p>Because of specific base pairing in DNA (i.e., adenine (A) always bonds with (thymine (T) and cytosine (C) always bonds with guanine (G)) the complimentary stand to the sequence 5' AATCGGATTGCA 3' would be 3' TTAGCCTAACGT 5'.</p><p>With palindromes the sequences on the complimentary strands read the same in either direction. For example, a sequence of 5' GAATTC3' on one strand would be complimented by a 3' CTTAAG 5' strand. In either case, when either strand is read from the 5' prime end the sequence is GAATTC. Another example of a palindrome would be the sequence 5' CGAAGC 3' that, when reversed, still reads CGAAGC.</p><p>Palindromes are important sequences within nucleic acids. Often they are the site of binding for specific enzymes (e.g., restriction endobucleases) designed to cut the DNA strands at specific locations (i.e., at palindromes).</p><p>Palindromes may arise from brakeage and chromosomal inversions that form inverted repeats that compliment each other. When a palindrome results from an inversion, it is often referred to as an inverted repeat. For example, the sequence 5' CGAAGC 3', if inverted (reversed 180&deg;), still reads CGAAGC.</p><p>The <a href="http://emboss.open-bio.org/">European Molecular Biology Open Software Suite (EMBOSS)</a> includes some basic tools for finding tandem repeats and inverted repeats (see <a href="http://emboss.open-bio.org/html/use/apbs06.html#GroupsAppsTableNucleicrepeatsR6">B.6.22. Applications in group Nucleic:repeats</a>). There are many on-line services providing the EMBOSS tools, for example:</p><ul>
<li>Wageningen Bioinformatics Webportal <a href="http://emboss.bioinformatics.nl/">EMBOSS explorer</a></li>
<li><a href="http://mobyle.pasteur.fr/">Mobyle@Pasteur</a></li>
<li><a href="http://wsembnet.vital-it.ch/">Soaplab2 Web Services at Vital-IT</a></li>
</ul><p>For more sophisticated repeat finding you will want to look at tools using <a href="http://www.girinst.org/repbase/">Repbase</a> for example:</p><ul>
<li>CENSOR
<ul>
<li><a href="http://www.girinst.org/censor/">CENSOR@GIRI</a></li>
<li><a href="http://www.ebi.ac.uk/Tools/so/censor/">CENSOR@EMBL-EBI</a></li>
</ul>
</li>
<li><a href="http://www.repeatmasker.org/">RepeatMasker</a></li>
<li><a href="http://mummer.sourceforge.net/">MUMmer</a>&nbsp;(scan_for_match)</li>
<li><a href="http://emboss.bioinformatics.nl/cgi-bin/emboss/palindrome">Emboss Palindrome</a></li>
</ul><p>Other nucleotide repeat finding methods found by a couple of web searches:</p><ul>
<li><a href="http://tandem.bu.edu/trf/trf.html">Tandem Repeats Finder</a></li>
<li><a href="http://selab.janelia.org/recon.html">RECON</a></li>
<li><a href="http://www.yandell-lab.org/software/repeatrunner.html">RepeatRunner</a></li>
<li><a href="http://bibiserv.techfak.uni-bielefeld.de/reputer/">REPuter</a></li>
<li><a href="http://210.212.215.200/IMEX/index.html">Imperfect Microsatellite Extractor (IMEx)</a></li>
<li><a href="http://www.imtech.res.in/raghava/srf/">Spectral Repeat Finder (SRF)</a></li>
<li><a href="http://zlab.bu.edu/repfind/form.html">REPFIND</a></li>
<li><a href="http://crispr.u-psud.fr/Server/CRISPRfinder.php">CRISPRfinder</a></li>
<li><a href="http://grail.lsd.ornl.gov/grailexp/">GrailEXP</a></li>
<li><a href="http://alggen.lsi.upc.edu/recerca/search/frame-search.html">CONREPP</a></li>
<li><a href="http://www.biophp.org/minitools/find_palindromes/demo.php%20"><span>find_palindromes</span></a></li>
<li><a href="http://insilico.ehu.eus/palindromes/"><span>Palindrome</span></a></li>
<li><a href="http://emboss.bioinformatics.nl/cgi-bin/emboss/palindrome">EMBOSS Palindrome</a></li>
<li><a href="http://bioinfo.cs.technion.ac.il/projects/Engel-Freund/new.html">Palindrome Search</a></li>
</ul>]]></description>
	<dc:creator>Radha Agarkar</dc:creator>
</item>
<item>
	<guid isPermaLink="true">https://bioinformaticsonline.com/pages/view/36398/tools-for-protein-protein-docking</guid>
	<pubDate>Wed, 25 Apr 2018 05:15:53 -0500</pubDate>
	<link>https://bioinformaticsonline.com/pages/view/36398/tools-for-protein-protein-docking</link>
	<title><![CDATA[Tools for Protein-Protein Docking !]]></title>
	<description><![CDATA[<p>Predicting the structure of protein&ndash;protein complexes using docking approaches is a difficult problem whose major challenges include identifying correct solutions, and properly dealing with molecular flexibility and conformational changes. Following are the tools to predict&nbsp;<span>the structure of protein&ndash;protein complexes:</span></p><p><a href="http://www.sbg.bio.ic.ac.uk/docking/index.html" target="_blank">3D-Dock Suite</a></p><p>Global rigid search: FFTShape complementarity and electrostatics</p><p>Re-scoring and clustering. Refinement of interface side-chains</p><p><a href="http://www.sbg.bio.ic.ac.uk/~3dgarden/" target="_blank">3D-Garden</a></p><p>Global rigid search in ensamble</p><p>Shape complementarity and Lennard&ndash;Jones potential</p><p>Side chain and backbone dihedral refinement</p><p><a href="http://www.sdsc.edu/CCMS/DOT/" target="_blank">DOT</a></p><p>Global rigid search: FFTShape complementarity, electrostatics and VDWNone</p><p><a href="http://users.unimi.it/~ddl/escherng/index.htm" target="_blank">Escher NG</a></p><p>Global rigid searchShape complementarity, hydrogen bonds and electrostatic</p><p>Integrated in&nbsp;<a href="http://users.unimi.it/~ddl/vega/download.htm" target="_blank">VEGA</a></p><p><a href="http://vakser.bioinformatics.ku.edu/resources/gramm/gramm1" target="_blank">GRAMM</a>&nbsp;</p><p>Global rigid search: FFT. smooth protein surface representation for soft docking</p><p>Shape complementarity and Lennard-Jones potential</p><p>Clustering of conformations</p><p><a href="http://vakser.bioinformatics.ku.edu/resources/gramm/grammx/" target="_blank">GRAMM-X</a>&nbsp;</p><p>Global rigid search: FFT. smooth protein surface representation for soft docking</p><p>Shape complementarity and Lennard-Jones potentialminimization and re-scoring with multiple filters</p><p><a href="http://www.loria.fr/~ritchied/hex_server/" target="_blank">HEX</a></p><p>Global rigid search: Fourier correlation of spherical harmonics</p><p>Shape complementarity</p><p><a href="http://www.csd.abdn.ac.uk/hex/" target="_blank"></a><a href="http://haddock.chem.uu.nl/Haddock/haddock.php" target="_blank">HADDOCK</a></p><p>Global rigid searchElectrostatic ,VDW and desolvation energy termsMD simulated annealing refinement . Filtering based on external data.&nbsp;</p><p><a href="http://www.molsoft.com/docking.html">ICM</a></p><p>Global rigid search: Monte CarloEmpirical scoring function</p><p>Clustering and selection of conformations. Refinement of interface side-chains and re-scoring</p><p><a href="http://www.weizmann.ac.il/Chemical_Research_Support/molfit/" target="_blank">MolFit&nbsp;</a></p><p>Global rigid search: FFTShape complementarity</p><p>Clustering of good solutions, filtering using&nbsp;<em>a priori&nbsp;</em>information and small, local rigid rotations around selected conformations</p><p><a href="http://bioinfo3d.cs.tau.ac.il/PatchDock/" target="_blank">PatchDock</a></p><p>Global rigid searchShape complementarity and atomic desolvation energy</p><p>Clustering of conformations</p><p><a href="http://inb.bsc.es/gn6/PyDock" target="_blank">PyDock</a></p><p>Global rigid search:FFTShape complementarity</p><p>rescoring by binding electrostatics and desolvation energy</p><p><a href="http://bioinfo3d.cs.tau.ac.il/PatchDock/" target="_blank"></a><a href="http://rosettadock.graylab.jhu.edu/" target="_blank">RosettaDock</a></p><p>Local rigid search: Monte Carlo with low and high resolution structure representation levels</p><p>Different scoring parameters for the different resolutions&nbsp;</p><p><a href="http://zlab.bu.edu/zdock/" target="_blank">ZDOCK</a></p><p>Global rigid search: FFTShape complementarity, desolvation energy, and electrostatics.</p><p>Energy minimization and re-scoringFree for academics</p><p>&nbsp;</p><p>Point to note:</p><p>The proper treatment of flexibility in protein&ndash;protein docking is still an active field of research. You first should analyzed your proteins in order to define their conformational space and then choose the most suitable method for your docking problem.</p>]]></description>
	<dc:creator>Poonam Mahapatra</dc:creator>
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