Computer-assisted structure elucidation (CASE)

    D01

    Scientific Data Management and Integrative Data Analysis
    Computer-assisted structure elucidation (CASE)
    Image: C. Steinbeck

    Project D01 provides the information management and sharing platform for the whole CRC AquaDiva. It will support the project-wide synthesis activities by providing integrated data products, e.g., it will work toward improving the data analysis for the chemical diversity and metabolic activities in the Critical Zone by constructing multi-omics data structures and perform computer-assisted structure elucidation of compounds in groundwater, which will be integrated into the Jena Database for Natural Products.

    Project Leaders

    Birgitta König-Ries

    Image: Birgitta König-Ries

    Prof. Dr. Birgitta König-Ries

    Heinz-Nixdorf Endowed Chair for Distributed Information Systems
    Friedrich Schiller University Jena
    Jentower, Leutragraben 1
    07743 Jena
    Phone: +49 (0)3641 946430
    e-mail

    Christoph Steinbeck

    Image: Anne Günther (University of Jena)

    Prof. Dr. Christoph Steinbeck

    Professorship Cheminformatics and Computational MetabolomicsExternal link
    Institute for Inorganic and Analytical Chemistry
    Friedrich Schiller University Jena
    Lessingstr. 8
    07743 Jena
    Phone: +49 (0)3641 948171
    e-mail




    Staff

    Researcher Dr. Alsayed Algergawy

    Image: Alsayed Algergawy

    Dr. Ing. Alsayed Algergawy

    Associated Researcher

    Heinz-Nixdorf Endowed Chair for Distributed Information SystemsExternal link
    Friedrich Schiller University Jena
    Jentower, Leutragraben 1, 07743 Jena
    Phone: +49 (0)3641 946438
    e-mail

    Currently:
    Guest Professor for Data and Knowledge EngineeringExternal link
    University of Passau
    Dr.-Hans-Kapfinger-Strasse 30, 94032 Passau
    e-mail

    Vinay Singh

    Image: Titas Mondal (JNU, New Delhi, India)

    Dr. Vinay Singh

    Postdoctoral Researcher

    Professorship Cheminformatics and ChemometricsExternal link
    Institute for Analytical Chemistry
    Friedrich Schiller University Jena
    Lessingstr. 8
    07743 Jena
    e-mail




    Hamdi Hamed

    Image: Hamdi Hamed

    Hamdi Hamed

    Developer

    Heinz-Nixdorf Endowed Chair for Distributed Information SystemsExternal link
    Friedrich Schiller University Jena
    Jentower, Leutragraben 1
    07743 Jena
    Phone: +49 (0)3641 946438
    e-mail

    Sven Thiel

    Image: Sven Thiel

    Sven Thiel

    Developer

    Heinz-Nixdorf Endowed Chair for Distributed Information SystemsExternal link
    Friedrich Schiller University Jena
    Jentower, Leutragraben 1
    07743 Jena
    Phone: +49 (0)3641 949409
    e-mail

    Ludmilla Figueiredo

    Image: Ludmilla Figueiredo

    Dr. Ludmilla Figueiredo

    Data Curator

    German Centre for Integrative Biodiversity Research (iDiv) Halle-Jena-Leipzig
    Puschstr. 4
    04103 Leipzig
    Phone: +49 (0)341 9739166
    e-mail

    Fabian Schreiter

    Image: Fabian Schreiter

    Fabian Schreiter

    Researcher

    Heinz-Nixdorf Endowed Chair for Distributed Information SystemsExternal link
    Friedrich Schiller University Jena
    Jentower, Leutragraben 1
    07743 Jena
    e-mail