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7th bwHPC Symposium

Europe/Berlin
Zoom Online Event (Ulm University)

Zoom Online Event

Ulm University

Description

Registration deadline now October 27th (due to technical problems on the 25th).

Wir laden Sie herzlich zum 7. bwHPC-Symposium am 8. November 2021 ein. Die Veranstaltung findet als Online-Event statt. Der Schwerpunkt der Konferenz liegt auf der Präsentation wissenschaftlicher Fortschritte und Erfolge, die mit Unterstützung der landesweiten bwHPC Hochleistungsrechner sowie der BaWü-Datenföderation erzielt werden konnten. Die Veranstaltung bietet eine hervorragende Gelegenheit zum aktiven Dialog zwischen den Forschenden, den Betriebsteams der bwHPC-Dienste sowie den Mitarbeitern und Mitarbeiterinnen der bwHPC-S5-Support-Zentren.


We invite you to participate in the upcoming 7th bwHPC Symposium on November 8th, 2021. The conference will take place online and focuses on the presentation of scientific projects and success stories carried out with the help of bwHPC high performance computing as well as the BaWü data federation. The event offers a unique opportunity to engage in an active dialog between the scientists, operators of the bwHPC services, and members of the bwHPC-S5 support centers.


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    • 08:45 09:15
      Opening of the conference room - Zoom login available Zoom Online Event

      Zoom Online Event

      Ulm University

      • 08:45
        Opening of the conference room - Zoom login available 30m
        Speaker: C. Mosch, F. Wagner
    • 09:15 09:25
      Welcome session - conference starts at 9:15 AM Zoom Online Event

      Zoom Online Event

      Ulm University

      • 09:15
        Welcome session - conference starts at 9:15 AM 10m Ulm University and Karlsruhe Institute of Technology

        Ulm University and Karlsruhe Institute of Technology

        Speaker: S. Wesner, B. Neumair
    • 09:25 10:10
      Plenary talk Zoom Online Event

      Zoom Online Event

      Ulm University

      • 09:25
        Plenary Talk - Quantum Computing 45m German Aerospace Center (DLR) and Ulm University

        German Aerospace Center (DLR) and Ulm University

        Speaker: W. P. Schleich
    • 10:10 10:20
      bwHPC and bwHPC-S5: (Chair: J. Salk) Zoom Online Event

      Zoom Online Event

      Ulm University

      • 10:10
        bwHPC and bwHPC-S5 10m Karlsruhe Institute of Technology and Ulm University

        Karlsruhe Institute of Technology and Ulm University

        Speaker: R. Barthel, J. Salk
    • 10:20 10:50
      bw2FDM + Science Data Centers (SDC): (Chair: A. Axtmann) Zoom Online Event

      Zoom Online Event

      Ulm University

      • 10:20
        bw2FDM + Science Data Centers (SDC) 30m For details see sub-contributions (click on the contribution and then on the details icon)

        For details see sub-contributions (click on the contribution and then on the details icon)

        bw2FDM: The information platform forschungsdaten.info
        A. Axtmann (Karlsruhe Institute of Technology)

        BioDATEN: Metadata generation and handling using bwHPC infrastructure
        H. Gauza (Tübingen University)

        BERD@BW: BERD Desktop - a secure environment for accessing and analyzing confidential data
        I. Schumm (Mannheim University)

        SDC4Lit: Science Data Center for Literature
        V. Kushnarenko (HLRS)

        MoMaF: Science Data Center for Molecular Material Research
        M. Selzer (Karlsruhe Institute of Technology)

        Speaker: A. Axtmann, H. Gauza, I. Schumm, V. Kushnarenko, M. Selzer
        • bw2FDM: The information platform forschungsdaten.info 6m

          Since the summer of 2019, the Ministry of Science, Research and Art of Baden Württemberg has been funding the research data management (RDM) project bw2FDM and the establishment of four science data centers (SDC). bw2FDM is dedicated to four task areas: 1. Coordinating the knowledge exchange between the SDCs and within the federal state. For that purpose working groups dedicated to cross-cutting topics like metadata or the legal aspects of RDM have been established. 2. Organization of the RDM-conference E-Science Days in Heidelberg. 3. Providing training and webinars as well as consultations with regard to RDM issues. 4. Management and development of forschungsdaten.info - the leading German-speaking RDM information platform.

          The short talk and poster highlight the content forschungsdaten.info offers regarding the topics "storage and computing" as well as "technical infastructures".

          Speaker: A. Axtmann (Karlsruhe Institute of Technology)
        • BioDATEN: Metadata generation and handling using bwHPC infrastructure 6m

          The Science Data Center BioDATEN aims at providing different services for the bioinformatic community in Baden-Württemberg. One aspect of this services is automated metadata generation using bwHPC / BinAC infrastructure and metadata handling. In this short talk, we present the current state and the connection to bwHPC.77

          Speaker: H. Gauza (Tübingen University)
        • BERD@BW: BERD Desktop - a secure environment for accessing and analyzing confidential data 6m

          BERD@BW is a Science Data Center for Business, Economic and related data with the aim to support its community in various aspects of research data management. The services built range from knowledge graphs and reconciliation tools, a repository for subject-specific algorithms, training and consulting on legal and IT issues to further development of the IT infrastructure according to the community's needs. A common use case of these subject areas is to work with sensitive or confidential data that cannot be shared openly. In this session, we will present our solution, a secure virtual desktop running on the bwCloud through which the data can be made available to researchers and be analyzed in a secure data analytics environment.

          Speaker: I. Schumm (Mannheim University)
        • SDC4Lit: Science Data Center for Literature 6m

          Has it ever happened to you - you try to access some web page that you visited one year ago, but it is not available any more? Or you want to investigate digital manuscripts created by your favourite writer, but visiting the archive is currently not possible? The Science Data Center for Literature (SDC4Lit) aims to establish a virtual data center for collection, preservation, cataloging, research and sharing of digital literary sources using computational methods to allow simple and even remote work with original materials. The main goals and challenges of the project will be covered in this presentation and in the following poster.

          Speaker: V. Kushnarenko (HLRS)
        • MoMaF: Science Data Center for Molecular Material Research 6m

          The long-term preservation and reuse of research data are not systematically organized in scientific disciplines ranging from molecular chemistry to materials science, and solutions of the individual research groups lead to a low availability and visibility of research results.
          So far, there is a lack of an urgently needed national and international institution to play the leading role by bundling competencies in research data storage, processing, curation, AI-supported analysis, and interdisciplinary reuse for the research fields between molecular chemistry and materials.

          Speaker: M. Selzer (Karlsruhe Institue of Techology)
    • 10:50 11:10
      Nationale Hochleistungsrechenzentren (NHR): (Chair: J. Salk) Zoom Online Event

      Zoom Online Event

      Ulm University

      • 10:50
        NHR - support for science 20m Geschäftsstelle für Nationales Hochleistungsrechnen

        Geschäftsstelle für Nationales Hochleistungsrechnen

        Speaker: D. Sternel
    • 11:10 11:20
      Coffee break
    • 11:20 12:20
      Geosciences & Astrophysics: (Chair: J. Krüger) Zoom Online Event

      Zoom Online Event

      Ulm University

      • 11:20
        Numerical Simulation of Tropospheric Ozone Depletion Events in the Arctic Spring 15m Heidelberg University

        Heidelberg University

        Speaker: M. Herrmann, E. Gutheil
      • 11:35
        Calibrating the soil-crop multi-model library Expert-N on high performance computers 15m Hohenheim University

        Hohenheim University

        Speaker: T. Weber
      • 11:50
        IllustrisTNG: Simulating the Universe 15m Heidelberg University

        Heidelberg University

        Speaker: D. Nelson
      • 12:05
        Probing the nature of black holes with X-rays 15m Tübingen University

        Tübingen University

        Speaker: S. Nampalliwar
    • 12:20 13:00
      Lunch break
    • 13:00 13:30
      Poster session part 1 Zoom Breakout Rooms (for list of posters => click on this session block, and then on the "session details" icon)

      Zoom Breakout Rooms (for list of posters => click on this session block, and then on the "session details" icon)

      • 13:00
        A Computational Workflow for Interdisciplinary Deep Learning Projects utilizing bwHPC Infrastructure 30m Breakout Room "Schilling"

        Breakout Room "Schilling"

        Speaker: M. P. Schilling (Karlsruhe Institute of Technology)
      • 13:00
        An assessment of quantum chemical tools for the analysis of host-guest interactions in COFs and MOFs 30m Breakout Room "Ernst"

        Breakout Room "Ernst"

        Speaker: M. Ernst (Heidelberg University)
      • 13:00
        Automated mapping of shrub individuals in S. Africa's Fynbos biome using drone imagery and deep learning 30m Breakout Room "Allen"

        Breakout Room "Allen"

        Speaker: N. Allen (Hohenheim University)
      • 13:00
        Automated simulation of thermophysical properties of mixtures with OpenMM on HoreKa (breakout room presentation cancelled) 30m Breakout Room "Schmitz"

        Breakout Room "Schmitz"

        Speaker: B. Schmitz (Stuttgart University)
      • 13:00
        bwVisu 30m Breakout Room "Schmoll"

        Breakout Room "Schmoll"

        Speaker: R. Schmoll (Heidelberg University)
      • 13:00
        Estimating a Mixture Model for Multidimensional Forced-Choice Data - The Faking Mixture Model 30m Breakout Room "Frick"

        Breakout Room "Frick"

        Speaker: S. Frick (Mannheim University)
      • 13:00
        forschungsdaten.info 30m Breakout Room "Axtmann"

        Breakout Room "Axtmann"

        Speaker: A. Axtmann (Karlsruhe Institut of Technology)
      • 13:00
        Numerical validation of cutting simulations for complex heat exchangers using 3D reverse engineered surfaces 30m Breakout Room "Mathlouthi"

        Breakout Room "Mathlouthi"

        Speaker: G. O. Mathlouthi (Ulm University of Applied Sciences)
      • 13:00
        Population genomic analysis of the rapid expansion of the fungal pathogen Setosphaeria turcica in Europe 30m Breakout Room "Freund"

        Breakout Room "Freund"

        Speaker: F. Freund (Hohenheim University)
      • 13:00
        Quantum-mechanical study of photoinduced processes in Direct laser Writing 30m Breakout Room "Mauri"

        Breakout Room "Mauri"

        Speaker: A. Mauri (Karlsruhe Institute of Technology)
      • 13:00
        SDC4Lit - Science Data Center for Literature 30m Breakout Room "Buck"

        Breakout Room "Buck"

        Speaker: N. Buck (HLRS Stuttgart)
      • 13:00
        Simulation of turbulent particle deposition in rough pipes using an Euler-Lagrange approach 30m Breakout Room "Akermann"

        Breakout Room "Akermann"

        Speaker: K. Akermann (Ulm University of Applied Sciences)
      • 13:00
        Student Cluster Competition 2021 30m Breakout Room "Malheiros"

        Breakout Room "Malheiros"

        Speaker: S. Malheiros (Heidelberg University)
    • 13:30 14:15
      Computational Chemistry & Pharmacy: (Chair: M. Thoss) Zoom Online Event

      Zoom Online Event

      Ulm University

      • 13:30
        Quantum chemistry and machine learning in computational materials and interface chemistry 15m
        Speaker: A. Groß
      • 13:45
        Multi-scale simulations of exciton and charge transfer processes in organic and biological materials 15m Karlsruhe Institue of Technology

        Karlsruhe Institue of Technology

        Speaker: M. Elstner
      • 14:00
        Machine Learning meets Quantum Chemistry 15m Tübingen University

        Tübingen University

        Speaker: F. Böckler
    • 14:15 15:00
      Particle Physics & Data Management: (Chair: M. Giffels) Zoom Online Event

      Zoom Online Event

      Ulm University

      • 14:15
        Opportunistic extension of a local compute cluster with NEMO resources for HEP workflows 15m Freiburg University

        Freiburg University

        Speaker: S. Kroboth
      • 14:30
        How to bring HTC data to HPC resources - A caching solution for the ATLAS computing environment in Freiburg 15m Freiburg University

        Freiburg University

        Speaker: D. Sammel
      • 14:45
        dtool: lightweight research data management 15m Freiburg University

        Freiburg University

        Speaker: J. L. Hörmann
    • 15:00 15:30
      Afternoon break & Poster session part 2 Zoom Breakout Rooms (see "Poster session part 1" for poster details)

      Zoom Breakout Rooms (see "Poster session part 1" for poster details)

    • 15:30 16:15
      Computer Sciences & Machine Learning: (Chair: T. Nau) Zoom Online Event

      Zoom Online Event

      Ulm University

      • 15:30
        Improving Learning of Neural Networks for Classification, Segmentation, and Associative Memory 15m HS Albstadt-Sigmaringen

        HS Albstadt-Sigmaringen

        Speaker: A. Knoblauch
      • 15:45
        Product Data Integration with Deep Learning 15m Mannheim University

        Mannheim University

        Speaker: R. Peeters
      • 16:00
        High Performance Uncertainty Quantification with Parallelized Multilevel Markov Chain Monte Carlo 15m Heidelberg University

        Heidelberg University

        Speaker: L. Seelinger
    • 16:15 17:00
      Biology & Life Sciences: (Chair: A. Neueder) Zoom Online Event

      Zoom Online Event

      Ulm University

      • 16:15
        Proteogenomic approaches applied to the study of cancer resistance and gut microbiome 15m Tübingen University

        Tübingen University

        Speaker: N. Nalpas
      • 16:30
        Thermodiffusion molekularer Fluide: Bottom-Up-Simulationen hin zu komplexen Systemen 15m Stuttgart University

        Stuttgart University

        Speaker: N. Zimmermann
      • 16:45
        Using cryo-electron microscopy to understand the structural basis of microtubule nucleation 15m Heidelberg University

        Heidelberg University

        Speaker: E. Župa
    • 17:00 17:15
      Farewell Zoom Online Event

      Zoom Online Event

      Ulm University

      • 17:00
        Farewell 15m
        Speaker: S. Wesner, B. Neumair
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