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  1. Article ; Online: Fast and accurate genome-wide predictions and structural modeling of protein–protein interactions using Galaxy

    Aysam Guerler / Dannon Baker / Marius van den Beek / Bjoern Gruening / Dave Bouvier / Nate Coraor / Stephen D. Shank / Jordan D. Zehr / Michael C. Schatz / Anton Nekrutenko

    BMC Bioinformatics, Vol 24, Iss 1, Pp 1-

    2023  Volume 13

    Abstract: Abstract Background Protein–protein interactions play a crucial role in almost all cellular processes. Identifying interacting proteins reveals insight into living organisms and yields novel drug targets for disease treatment. Here, we present a publicly ...

    Abstract Abstract Background Protein–protein interactions play a crucial role in almost all cellular processes. Identifying interacting proteins reveals insight into living organisms and yields novel drug targets for disease treatment. Here, we present a publicly available, automated pipeline to predict genome-wide protein–protein interactions and produce high-quality multimeric structural models. Results Application of our method to the Human and Yeast genomes yield protein–protein interaction networks similar in quality to common experimental methods. We identified and modeled Human proteins likely to interact with the papain-like protease of SARS-CoV2’s non-structural protein 3. We also produced models of SARS-CoV2’s spike protein (S) interacting with myelin-oligodendrocyte glycoprotein receptor and dipeptidyl peptidase-4. Conclusions The presented method is capable of confidently identifying interactions while providing high-quality multimeric structural models for experimental validation. The interactome modeling pipeline is available at usegalaxy.org and usegalaxy.eu.
    Keywords Protein–protein interactions ; Structural modeling ; Galaxy workflow ; Computer applications to medicine. Medical informatics ; R858-859.7 ; Biology (General) ; QH301-705.5
    Language English
    Publishing date 2023-06-01T00:00:00Z
    Publisher BMC
    Document type Article ; Online
    Database BASE - Bielefeld Academic Search Engine (life sciences selection)

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  2. Article ; Online: No more business as usual

    Dannon Baker / Marius van den Beek / Daniel Blankenberg / Dave Bouvier / John Chilton / Nate Coraor / Frederik Coppens / Ignacio Eguinoa / Simon Gladman / Björn Grüning / Nicholas Keener / Delphine Larivière / Andrew Lonie / Sergei Kosakovsky Pond / Wolfgang Maier / Anton Nekrutenko / James Taylor / Steven Weaver

    PLoS Pathogens, Vol 16, Iss 8, p e

    Agile and effective responses to emerging pathogen threats require open data and open analytics.

    2020  Volume 1008643

    Abstract: The current state of much of the Wuhan pneumonia virus (severe acute respiratory syndrome coronavirus 2 [SARS-CoV-2]) research shows a regrettable lack of data sharing and considerable analytical obfuscation. This impedes global research cooperation, ... ...

    Abstract The current state of much of the Wuhan pneumonia virus (severe acute respiratory syndrome coronavirus 2 [SARS-CoV-2]) research shows a regrettable lack of data sharing and considerable analytical obfuscation. This impedes global research cooperation, which is essential for tackling public health emergencies and requires unimpeded access to data, analysis tools, and computational infrastructure. Here, we show that community efforts in developing open analytical software tools over the past 10 years, combined with national investments into scientific computational infrastructure, can overcome these deficiencies and provide an accessible platform for tackling global health emergencies in an open and transparent manner. Specifically, we use all SARS-CoV-2 genomic data available in the public domain so far to (1) underscore the importance of access to raw data and (2) demonstrate that existing community efforts in curation and deployment of biomedical software can reliably support rapid, reproducible research during global health crises. All our analyses are fully documented at https://github.com/galaxyproject/SARS-CoV-2.
    Keywords Immunologic diseases. Allergy ; RC581-607 ; Biology (General) ; QH301-705.5 ; covid19
    Subject code 306
    Language English
    Publishing date 2020-08-01T00:00:00Z
    Publisher Public Library of Science (PLoS)
    Document type Article ; Online
    Database BASE - Bielefeld Academic Search Engine (life sciences selection)

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  3. Article: Dissemination of scientific software with Galaxy ToolShed

    Blankenberg, Daniel / Anton Nekrutenko / Dannon Baker / Emil Bouvier / Enis Afgan / Gregory Von Kuster / James Taylor / Nicholas Stoler

    Genome biology. 2014 Feb., v. 15, no. 2

    2014  

    Abstract: The proliferation of web-based integrative analysis frameworks has enabled users to perform complex analyses directly through the web. Unfortunately, it also revoked the freedom to easily select the most appropriate tools. To address this, we have ... ...

    Institution Galaxy Team
    Abstract The proliferation of web-based integrative analysis frameworks has enabled users to perform complex analyses directly through the web. Unfortunately, it also revoked the freedom to easily select the most appropriate tools. To address this, we have developed Galaxy ToolShed.
    Keywords bioinformatics ; computer software ; Internet ; research methods
    Language English
    Dates of publication 2014-02
    Size p. 403.
    Publishing place BioMed Central
    Document type Article
    ZDB-ID 2040529-7
    ISSN 1474-760X ; 1465-6914 ; 1465-6906
    ISSN (online) 1474-760X ; 1465-6914
    ISSN 1465-6906
    DOI 10.1186/gb4161
    Database NAL-Catalogue (AGRICOLA)

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