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<channel>
	<title><![CDATA[BOL: Related items]]></title>
	<link>https://bioinformaticsonline.com/related/8265?offset=50</link>
	<atom:link href="https://bioinformaticsonline.com/related/8265?offset=50" rel="self" type="application/rss+xml" />
	<description><![CDATA[]]></description>
	
	
<item>
  <guid isPermaLink='true'>https://bioinformaticsonline.com/opportunity/view/33794/senior-bioinformatics-software-developer-hyderabad-telangana</guid>
  <pubDate>Mon, 03 Jul 2017 10:10:31 -0500</pubDate>
  <link></link>
  <title><![CDATA[Senior Bioinformatics Software Developer, Hyderabad, Telangana]]></title>
  <description><![CDATA[
<p>DuPont Pioneer is the world leader in plant biotechnology area including discovery, development and delivery of elite crop genetics. DuPont Pioneer is aggressively building Big Data and Predictive Analytics capabilities in order to deliver improved services to our customers. We are currently seeking Senior Bioinformatics Software Developer at the DuPont Knowledge Center in Hyderabad, India for our global Data Science and Informatics group. At DuPont Pioneer, you’ll become part of a work environment that nurtures your interests, ignites your passion, creates opportunities to serve and helps you attain success–both personally and professionally. The hiring level will be commensurate with the level of experience. This is a critical position with the potential to make immediate, significant impact on our business.<br />The successful candidate will have an extensive background in computer science and bioinformatics through courses or academic degrees, and proven experience in bioinformatics software development. We are looking for those creative, smart, model driven, agile individuals who enjoy giving their all to tackle diverse software needs.<br />Duties / Responsibilities</p>

<p>Job Qualifications<br />Education and Experience<br />•	Master Degree in Bioinformatics, Computational biology, Scientific Computing or related field <br />•	3-5 years of Post-Master’s experience in Bioinformatics software development <br />•	Proven experience developing high throughput bioinformatics applications<br />Required Competencies<br />•	Strong proven experience in Python programming language in Linux environment<br />•	Proven High Performance computing experience (LSF/SGE/OGE)<br />•	Exposure in code versioning and repository management (GIT/SVN)<br />•	Proven experience in Bioinformatics algorithm development<br />•	Deep understanding in Bioinformatics tools, data types<br />Desired Competencies<br />•	Familiarity working in a scientific computing environment (NumPy, SciPy, Pandas etc.)<br />•	Familiarity working with Cloud technologies (AWS, Azure)<br />•	Ability to demonstrate solid analytical skills and exceptional attention to detail.<br />•	Experience in relational databases and data structures<br />•	Proven experience working with teams using agile software development methodologies and processes<br />•	Familiarity with Service Oriented Architecture (SOA)<br />•	Familiarity with build tools (Jenkins, make, ANT, Maven)<br />•	Exposure to project management tools (JIRA, Confluence, RED MINE, etc.)</p>

<p>More at http://careers.dupont.com/jobsearch/job-details/senior-bioinformatics-software-developer/012939W-01/</p>
]]></description>
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<item>
	<guid isPermaLink="true">https://bioinformaticsonline.com/blog/view/34916/bioinformatics-tools-developed-for-oxford-nanopore-data-analysis</guid>
	<pubDate>Wed, 27 Dec 2017 20:47:30 -0600</pubDate>
	<link>https://bioinformaticsonline.com/blog/view/34916/bioinformatics-tools-developed-for-oxford-nanopore-data-analysis</link>
	<title><![CDATA[Bioinformatics tools developed for Oxford Nanopore data analysis !]]></title>
	<description><![CDATA[<p><span>MinION is the only portable real-time device for DNA and RNA&nbsp;</span><span>sequencing</span><span>. Each consumable flow cell can now generate 10&ndash;20 Gb of DNA&nbsp;</span><span>sequence</span><span>&nbsp;data. Ultra-</span><span>long read lengths are possible (hundreds of kb) as you can choose your fragment length.&nbsp;</span>One of the technical advantages of ONT data is the read length, which offers great prospects for genome assembly. Generally, assemblers are based on several different types of algorithms, such as greedy, overlap-layout-consensus (OLC), de Bruijn graph (DBG), and string graph.</p><p><span>List of analysis tools developed for Oxford Nanopore data</span></p><p>BWA <br />Fast nanopore data tuned alignment tool <br />https://github.com/lh3/bwa</p><p>GraphMap<br />Mapper for long and error-prone reads<br />https://github.com/isovic/graphmap</p><p>LAST<br />Nanopore tuned alignment tool<br />http://last.cbrc.jp/</p><p>LINKS<br />Software tool for long read scaffolding <br />https://github.com/warrenlr/LINKS/</p><p>marginAlign<br />Tools to align nanopore reads to a reference<br />https://github.com/benedictpaten/marginAlign</p><p>minoTour<br />Real time analysis tools<br />http://minotour.nottingham.ac.uk/</p><p>nanoCORR<br />Error-correction tool for nanopore sequence data<br />https://github.com/jgurtowski/nanocorr</p><p>NanoOK<br />Software for nanopore data, quality and error profiles<br />https://documentation.tgac.ac.uk/display/NANOOK/NanoOK</p><p>Nanopolish<br />Nanopore analysis and genome assembly software<br />https://github.com/jts/nanopolish</p><p>nanopore<br />Variant-detection tool for nanopore sequence data<br />https://github.com/mitenjain/nanopore</p><p>Nanocorrect<br />Error-correction tool for nanopore sequence data<br />https://github.com/jts/nanocorrect/</p><p>npReader<br />Real-time conversion and analysis of nanopore reads<br />https://github.com/mdcao/npReader</p><p>poRe<br />Tool for analyzing and visualizing nanopore data<br />https://sourceforge.net/p/rpore/wiki/Home/</p><p>PoreSeq<br />Error-correction and variant-calling software<br />https://github.com/tszalay/poreseq</p><p>Poretools<br />Nanopore sequence analysis and visualization software <br />https://github.com/arq5x/poretools</p><p>SSPACE-LongRead<br />Genome scaffolding tool <br />http://www.baseclear.com/genomics/bioinformatics/basetools/SSPACE-longread</p><p>SMIS<br />Genome scaffolding tool <br />https://sourceforge.net/projects/phusion2/files/smis/</p><p>&nbsp;</p><p>List of assemblers for Oxford Nanopore MinION long reads</p><p>LQS<br />DALIGNER, Celera OLC Nanocorrect, <br />Nanopolish corrector<br />https://github.com/jts/nanopolish</p><p>PBcR<br />HGAP or BLASR, Celera OLC <br />PBcR corrector<br />http://wgs-assembler.sourceforge.net/wiki/index.php/PBcR<br /> &ndash;<br />Canu<br />MHAP, Celera OLC <br />Canu corrector<br />https://github.com/marbl/canu</p><p>Falcon<br />String graph, Celera OLC <br />Falcon corrector<br />https://github.com/PacificBiosciences/falcon</p><p>Miniasm <br />OLC<br />https://github.com/lh3/miniasm</p><p>ra-integrate<br />OLC<br />https://github.com/mariokostelac/ra-integrate/</p><p>ALLPATHS-LG<br />de Bruijn graph <br />ALLPATHS-L corrector<br />https://www.broadinstitute.org/software/allpaths-lg/blog/?page_id=12</p><p>SPAdes <br />de Bruijn graph <br />SPAdes corrector<br />http://bioinf.spbau.ru/spades</p>]]></description>
	<dc:creator>biogeek</dc:creator>
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	<guid isPermaLink="true">https://bioinformaticsonline.com/pages/view/36384/binding-site-prediction-in-protein</guid>
	<pubDate>Wed, 25 Apr 2018 04:35:57 -0500</pubDate>
	<link>https://bioinformaticsonline.com/pages/view/36384/binding-site-prediction-in-protein</link>
	<title><![CDATA[Binding Site Prediction in Protein !]]></title>
	<description><![CDATA[<p><span>The interaction between proteins and other molecules is fundamental to all biological functions. In this section we include tools that can assist in prediction of interaction sites on protein surface and tools for predicting the structure of the intermolecular complex formed between two or more molecules (docking).</span></p><h4>Pockets Identification</h4><p><a href="http://sts.bioengr.uic.edu/castp/" target="_blank">CASTp</a></p><div style="text-align: justify;">Automatic Identification of pockets and cavities in proteins structure, and quantitation of their volumes using Delaunay triangulation. Available also as PyMOL plugin</div><p><a href="http://www.bioinformatics.leeds.ac.uk/pocketfinder/" target="_blank">Pocket-Finder</a></p><div style="text-align: justify;">Automatic identification of pockets and cavities in proteins structure, and quantitation of their volumes.</div><p><a href="http://gecco.org.chemie.uni-frankfurt.de/pocketpicker/index.html" target="_blank">PocketPicker</a></p><div style="text-align: justify;">Grid-based technique for the analysis of protein pockets. PocketPicker available as a plugin for&nbsp;<a href="https://bip.weizmann.ac.il/toolbox/structure/pymol.htm">PyMOL</a></div><div style="text-align: justify;">&nbsp;</div><div style="text-align: justify;"><h4>Binding Site Prediction</h4>
<p><a href="http://consurf.tau.ac.il/" target="_blank">ConSurf</a></p>
</div><div style="text-align: justify;">&nbsp;</div><div style="text-align: justify;">Identification of functional regions in proteins by surface-mapping of phylogenetic information</div><div style="text-align: justify;">&nbsp;</div><div style="text-align: justify;"><a href="http://www-cryst.bioc.cam.ac.uk/~crescendo/crescendo.php" target="_blank">CRESCENDO</a></div><div style="text-align: justify;">&nbsp;</div><div style="text-align: justify;">Identification protein interaction sites. It uses sequence conservation patterns in homologous proteins to distinguish between residues that are conserved due to structural restraints from those due to functional restraints.&nbsp;&nbsp;</div><div style="text-align: justify;">&nbsp;</div><div style="text-align: justify;"><strong>Ligand Binding Sites</strong></div><div style="text-align: justify;">&nbsp;</div><div style="text-align: justify;"><a href="http://www.sbg.bio.ic.ac.uk/~3dligandsite/" target="_blank">3DLigandSite</a></div><div style="text-align: justify;">&nbsp;</div><div style="text-align: justify;">The server utilizes protein-structure prediction to provide structural models of the binding site. Ligands bound to structures are superimposed onto the model and use to predict the binding site.</div><div style="text-align: justify;">&nbsp;</div><div style="text-align: justify;">F<a href="http://cssb.biology.gatech.edu/skolnick/files/FINDSITE/" target="_blank">INDSITE</a></div><div style="text-align: justify;">&nbsp;</div><div style="text-align: justify;">A threading-based method for ligand-binding site prediction and functional annotation based on binding-site similarity across superimposed groups of threading templates.</div><div style="text-align: justify;">&nbsp;</div><div style="text-align: justify;">
<p><a href="http://scoppi.biotec.tu-dresden.de/pocket/" target="_blank">LIGSITE<sup>csc</sup></a></p>
<div style="text-align: justify;">&nbsp;</div><div style="text-align: justify;">Prediction of binding site by pocket identification using the Connolly surface and degree of conservation</div>
<p><a href="http://metapocket.eml.org/" target="_blank"></a></p>
</div><div style="text-align: justify;">&nbsp;</div><div style="text-align: justify;"><a href="http://metapocket.eml.org/" target="_blank">metaPocket</a>A meta server for ligand-binding site prediction. metaPocket use&nbsp;<a href="https://bip.weizmann.ac.il/toolbox/structure/binding.htm#ligsite">LIGSITE<sup>csc</sup></a>,&nbsp;<a href="https://bip.weizmann.ac.il/toolbox/structure/binding.htm#pass">PASS</a>,&nbsp;<a href="https://bip.weizmann.ac.il/toolbox/structure/binding.htm#qsite">Q-SiteFinder</a>&nbsp;and&nbsp;<a href="http://www.biochem.ucl.ac.uk/~roman/surfnet/surfnet.html" target="_blank">SURFNET</a></div>]]></description>
	<dc:creator>Poonam Mahapatra</dc:creator>
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<item>
  <guid isPermaLink='true'>https://bioinformaticsonline.com/opportunity/view/41905/research-associate-bioinformatics-in-iisc-recruitment-2020</guid>
  <pubDate>Tue, 23 Jun 2020 21:53:34 -0500</pubDate>
  <link></link>
  <title><![CDATA[Research Associate Bioinformatics in IISc Recruitment 2020]]></title>
  <description><![CDATA[
<p>Research Associate Bioinformatics in IISc Recruitment 2020</p>

<p>Essential Qualifications: Ph.D. (Bioinformatics/ Biophysics/ Biotechnology or any other stream of biological/ physical sciences) with a minimum of two publications in reputed peer reviewed journals in the area of structural bioinformatics or biophysics or biomolecular modeling/ simulation.</p>

<p>Job description: Development of bioinformatics tools and algorithms/software for structure based analysis of biomolecular systems. Programmatic access to major biomolecular databases using APIs Knowledge based prediction and analysis of biomolecular structure, function and interactions. Docking/simulations for inhibitor design.</p>

<p>Desirable Qualifications (Research Associate/s): i)  Strong computer programming skills (in Python/PERL/PHP or C++ or object oriented database management systems like MySQL etc or scripting languages under LINUX/UNIX environment). </p>

<p>ii) Extensive experience in computational analysis of biomolecular structure/interactions and usage of advanced biomolecular simulation softwares. iii) Adequate knowledge of major databases, webservers and softwares in the area of biomolecular structure/function and drug design. iv)  Familiarity with Parallel Programming environments and experience in usage of high-end HPC clusters.</p>

<p>The candidates must highlight their experience in above mentioned fields/topics in their CV. Initial appointment will be for a period of 1 year, subject to extension after review of performance.</p>

<p>Emoluments: As per DST, GOI norms and commensurate with experience.</p>

<p>More at https://www.iisc.ac.in/positions-open/</p>
]]></description>
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	<guid isPermaLink="true">https://bioinformaticsonline.com/news/view/4162/4273%CF%80-bioinformatics-education-on-low-cost-arm-hardware</guid>
	<pubDate>Mon, 02 Sep 2013 07:02:43 -0500</pubDate>
	<link>https://bioinformaticsonline.com/news/view/4162/4273%CF%80-bioinformatics-education-on-low-cost-arm-hardware</link>
	<title><![CDATA[4273π: Bioinformatics education on low cost ARM hardware]]></title>
	<description><![CDATA[<p>Are you teaching bioinformatics at universities and found it complicated by typical computer classroom settings. As well as running software locally and online, students should gain experience of systems administration. Hmm don't worry there is one new OS for the rescue. 4273<em>&pi;</em>, an operating system image for Raspberry Pi based on Raspbian Linux. It provides an attractive, general-purpose computing environment, within which the course 4273&pi; Bioinformatics for Biologists is embedded.<br /><br />Though far slower than current desktop and laptop computers, the Raspberry Pi is notably faster than the Cray 1 supercomputer, a marvel of computer speed in its day. The Raspberry Pi approach includes all the benefits of the laptop approach, above, but at lower cost. In addition, the Raspberry Pi is a new and exciting computer system, which in itself can add interest to the course.<br /><br />As the Raspbian operating system, Raspberry Pi firmware and hardware and 4273&pi; Bioinformatics for Biologists teaching material develop, further releases of 4273&pi; will be made available. It is anticipated that there will be a minimum of two releases per year during the next four years.</p><p>4273<em>&pi;</em> is a means to teach bioinformatics, including systems administration tasks, to undergraduates at low cost.</p><p>Descriptive paper @ http://www.biomedcentral.com/1471-2105/14/243</p><p>Image source: BMC Bioinformatics</p><p><img src="http://www.biomedcentral.com/content/download/figures/1471-2105-14-243-1.png" alt="image" style="border: 0px; border: 0px;"></p>]]></description>
	<dc:creator>Jitendra Narayan</dc:creator>
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	<guid isPermaLink="true">https://bioinformaticsonline.com/bookmarks/view/42499/galaxy-training-resources</guid>
	<pubDate>Sun, 27 Dec 2020 05:28:07 -0600</pubDate>
	<link>https://bioinformaticsonline.com/bookmarks/view/42499/galaxy-training-resources</link>
	<title><![CDATA[Galaxy Training Resources !]]></title>
	<description><![CDATA[<p>Welcome to Galaxy Training!</p>
<p>Collection of tutorials developed and maintained by the worldwide Galaxy community</p>
<table>
<thead>
<tr><th>Topic</th><th>Tutorials</th></tr>
</thead>
<tbody>
<tr>
<td><a href="https://training.galaxyproject.org/training-material/topics/introduction/">Introduction to Galaxy Analyses</a></td>
<td>10</td>
</tr>
<tr>
<td><a href="https://training.galaxyproject.org/training-material/topics/assembly/">Assembly</a></td>
<td>6</td>
</tr>
<tr>
<td><a href="https://training.galaxyproject.org/training-material/topics/climate/">Climate</a></td>
<td>3</td>
</tr>
<tr>
<td><a href="https://training.galaxyproject.org/training-material/topics/computational-chemistry/">Computational chemistry</a></td>
<td>6</td>
</tr>
<tr>
<td><a href="https://training.galaxyproject.org/training-material/topics/ecology/">Ecology</a></td>
<td>6</td>
</tr>
<tr>
<td><a href="https://training.galaxyproject.org/training-material/topics/epigenetics/">Epigenetics</a></td>
<td>6</td>
</tr>
<tr>
<td><a href="https://training.galaxyproject.org/training-material/topics/genome-annotation/">Genome Annotation</a></td>
<td>3</td>
</tr>
<tr>
<td><a href="https://training.galaxyproject.org/training-material/topics/imaging/">Imaging</a></td>
<td>3</td>
</tr>
<tr>
<td><a href="https://training.galaxyproject.org/training-material/topics/metabolomics/">Metabolomics</a></td>
<td>4</td>
</tr>
<tr>
<td><a href="https://training.galaxyproject.org/training-material/topics/metagenomics/">Metagenomics</a></td>
<td>7</td>
</tr>
<tr>
<td><a href="https://training.galaxyproject.org/training-material/topics/proteomics/">Proteomics</a></td>
<td>18</td>
</tr>
<tr>
<td><a href="https://training.galaxyproject.org/training-material/topics/sequence-analysis/">Sequence analysis</a></td>
<td>2</td>
</tr>
<tr>
<td><a href="https://training.galaxyproject.org/training-material/topics/statistics/">Statistics and machine learning</a></td>
<td>8</td>
</tr>
<tr>
<td><a href="https://training.galaxyproject.org/training-material/topics/transcriptomics/">Transcriptomics</a></td>
<td>23</td>
</tr>
<tr>
<td><a href="https://training.galaxyproject.org/training-material/topics/variant-analysis/">Variant Analysis</a></td>
<td>8</td>
</tr>
<tr>
<td><a href="https://training.galaxyproject.org/training-material/topics/visualisation/">Visualisation</a></td>
<td>2</td>
</tr>
</tbody>
</table>
<p>&nbsp;</p><p>Address of the bookmark: <a href="https://training.galaxyproject.org/training-material/" rel="nofollow">https://training.galaxyproject.org/training-material/</a></p>]]></description>
	<dc:creator>Jit</dc:creator>
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<item>
	<guid isPermaLink="true">https://bioinformaticsonline.com/fun/view/4196/chemical-elements-of-bioinformatics</guid>
	<pubDate>Tue, 03 Sep 2013 16:35:39 -0500</pubDate>
	<link>https://bioinformaticsonline.com/fun/view/4196/chemical-elements-of-bioinformatics</link>
	<title><![CDATA[Chemical Elements of Bioinformatics]]></title>
	<description><![CDATA[<p>You must be familiar with periodic table and colour pattern, but this time you are going to amaze by new elements table by Eagle genomics. Just check it out and have fun :)</p><p><a href="http://elements.eaglegenomics.com/">http://elements.eaglegenomics.com/</a></p>]]></description>
	<dc:creator>Rahul Agarwal</dc:creator>
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	<guid isPermaLink="true">https://bioinformaticsonline.com/pages/view/44352/bioinformatics-tools-for-genome-assembly</guid>
	<pubDate>Mon, 24 Jul 2023 07:04:26 -0500</pubDate>
	<link>https://bioinformaticsonline.com/pages/view/44352/bioinformatics-tools-for-genome-assembly</link>
	<title><![CDATA[Bioinformatics tools for genome assembly !]]></title>
	<description><![CDATA[<p>There are numerous genome assembly tools available, each with its strengths and weaknesses. Here is a list of some widely used genome assembly tools as of my last update in September 2021:</p><ol>
<li>
<p><span>SPAdes:</span> An assembler specifically designed for single-cell and multi-cell bacterial genomes, as well as small eukaryotic genomes.</p>
</li>
<li>
<p><span>ABySS:</span> A parallelized assembler for large genomes that uses de Bruijn graphs.</p>
</li>
<li>
<p><span>Velvet:</span> Another de Bruijn graph-based assembler optimized for short-read sequencing data.</p>
</li>
<li>
<p><span>SOAPdenovo:</span> A de Bruijn graph-based assembler designed for short reads, widely used for assembling large and complex genomes.</p>
</li>
<li>
<p><span>MaSuRCA:</span> A hybrid assembler that combines data from multiple sequencing technologies, such as Illumina and PacBio.</p>
</li>
<li>
<p><span>Canu:</span> A long-read assembler optimized for PacBio and Oxford Nanopore sequencing data.</p>
</li>
<li>
<p><span>Flye:</span> A long-read assembler suitable for bacterial and small eukaryotic genomes.</p>
</li>
<li>
<p><span>SMARTdenovo:</span> An assembler designed for long reads, particularly suited for PacBio data.</p>
</li>
<li>
<p><span>SPAdes Long Read (SPAdesLR):</span> An extension of SPAdes for long-read data, such as those from PacBio or Nanopore.</p>
</li>
<li>
<p><span>Minia:</span> An assembler optimized for low memory consumption, suitable for small and medium-sized genomes.</p>
</li>
<li>
<p><span>Unicycler:</span> A hybrid assembler that combines short and long reads for circular bacterial genome assembly.</p>
</li>
<li>
<p><span>wtdbg2:</span> A de Bruijn graph assembler for long reads, efficient for very large genomes.</p>
</li>
<li>
<p><span>Shasta:</span> A long-read assembler that uses the Overlap-Layout-Consensus approach, suitable for PacBio and Nanopore data.</p>
</li>
<li>
<p><span>Sparc:</span> An assembler designed to handle noisy long reads from Nanopore sequencing.</p>
</li>
<li>
<p><span>CANA:</span> An assembler for metagenomic data, particularly for complex and diverse microbial communities.</p>
</li>
<li>
<p><span>Ra</span> Assembler: A metagenome assembler for long reads, designed for highly complex metagenomic samples.</p>
</li>
</ol><p>Please note that the field of bioinformatics is constantly evolving, and new assembly tools may have emerged since my last update. Additionally, the performance of these tools can vary depending on the characteristics of the sequencing data and the genome being assembled. When selecting an assembly tool, consider the specific requirements of your project, the available data types, and the computational resources at your disposal. Always refer to the respective tool's documentation and publications for the most up-to-date information and recommendations.</p>]]></description>
	<dc:creator>BioStar</dc:creator>
</item>
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	<guid isPermaLink="true">https://bioinformaticsonline.com/bookmarks/view/44581/biokit-a-set-of-tools-dedicated-to-bioinformatics-data-visualisation</guid>
	<pubDate>Tue, 18 Jun 2024 02:04:39 -0500</pubDate>
	<link>https://bioinformaticsonline.com/bookmarks/view/44581/biokit-a-set-of-tools-dedicated-to-bioinformatics-data-visualisation</link>
	<title><![CDATA[BioKit: a set of tools dedicated to bioinformatics, data visualisation]]></title>
	<description><![CDATA[<p><span>BioKit is a set of tools dedicated to bioinformatics, data visualisation (</span><a href="https://biokit.readthedocs.io/en/latest/references.html#module-biokit.viz" title="biokit.viz"><code><span>biokit.viz</span></code></a><span>), access to online biological data (e.g. UniProt, NCBI thanks to bioservices). It also contains more advanced tools related to data analysis (e.g.,&nbsp;</span><a href="https://biokit.readthedocs.io/en/latest/references.html#module-biokit.stats" title="biokit.stats"><code><span>biokit.stats</span></code></a><span>). Since R is quite common in bioinformatics, we also provide a convenient module to run R inside your Python scripts or shell (:mod:biokit.rtools module).</span></p><p>Address of the bookmark: <a href="https://biokit.readthedocs.io/en/latest/index.html" rel="nofollow">https://biokit.readthedocs.io/en/latest/index.html</a></p>]]></description>
	<dc:creator>Neel</dc:creator>
</item>
<item>
	<guid isPermaLink="true">https://bioinformaticsonline.com/pages/view/36395/ligand-docking-tools-and-software</guid>
	<pubDate>Wed, 25 Apr 2018 05:05:17 -0500</pubDate>
	<link>https://bioinformaticsonline.com/pages/view/36395/ligand-docking-tools-and-software</link>
	<title><![CDATA[Ligand Docking Tools and Software !]]></title>
	<description><![CDATA[<p>Ligand docking referred to cases where small molecule (&ldquo;ligand&rdquo;) is being docked into much larger macromolecule ("target"). The following is partial list of docking software, focusing on free (at least for academic institutes) and/or popular docking tools.&nbsp;</p><p><a href="http://autodock.scripps.edu/" target="_blank">AutoDock</a></p><p>Stochastic (GA)</p><p>Flexible ligand and partially flexible target</p><p><a href="http://www.arguslab.com/" target="_blank">ArgusLab</a></p><p>Systematic</p><p>Flexible ligandX-Score based</p><p><a href="http://dock.compbio.ucsf.edu/" target="_blank">DOCK</a></p><p>Systematic (IC)</p><p>Flexible ligandDOCK 3.5 (force field)</p><p><a href="http://www.simbiosys.ca/ehits/index.html" target="_blank">eHITS</a></p><p>Systematic (RBD of fragments followed by reconstruction)Flexible ligand and partially flexible targetHiTS_Score (empirical)</p><p><a href="http://www.biosolveit.de/" target="_blank">FlexX</a></p><p>Systematic (IC)Flexible ligandFlexX SF (empirical)Commercial</p><p><a href="http://flipdock.scripps.edu/" target="_blank">FLIPDock</a></p><p>Stochastic (GA)Flexible ligand and flexible targetAUTODOCK (empirical)</p><p><a href="http://www.eyesopen.com/products/applications/fred.html" target="_blank">FRED</a></p><p>Systematic (RBD)Flexible ligandChemScore, PLP, ScreenScore, ChemGauss (empirical/consensus)</p><p><a href="http://www.ccdc.cam.ac.uk/products/life_sciences/gold/" target="_blank">GOLD</a></p><p>Stochastic (GA)</p><p>Flexible ligand and partially flexible targetGoldScore, ChemScore (empirical), ASP (knowledge based)</p><p><a href="http://www.molsoft.com/docking.html" target="_blank">ICM</a></p><p>Stochastic (MC)</p><p>Flexible ligand and partially flexible targetICM SF (empirical)</p><p><a href="http://www.scfbio-iitd.res.in/dock/pardock.jsp" target="_blank">ParDOCK</a></p><p>Stochastic (MC)</p><p>RigidBAPPL (empirical)</p><p><em><a href="http://www.scfbio-iitd.res.in/dock/pardock.jsp" target="_blank"></a></em><a href="http://www.tcd.uni-konstanz.de/research/plants.php" target="_blank">PLANTS</a></p><p>Stochastic (ACO)Flexible ligand and partially flexible target</p><p>CHEMPLP, PLP (empirical)</p><p><a href="http://www.biopharmics.com/" target="_blank">Surflex</a></p><p>Systematic (IC/MA)Flexible ligandHammerhead based (empirical)</p><p>Point to note:</p><p>Several studies have shown that the performance of most docking tools is highly dependent on the particular characteristics of both the binding site and the ligand to be investigated, and the determination which method would be more suitable in a specific context is difficult. We encouraged you to check several docking methods to determine which one(s) work best for your system.</p><p>&nbsp;</p><p><a href="http://autodock.scripps.edu/" target="_blank"></a></p>]]></description>
	<dc:creator>Poonam Mahapatra</dc:creator>
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