1. Computational Science Center Seminar

    "Enabling Re-executable Workflows with Near-real-time Visualization, Provenance Capture and Advanced Querying for Mass Spectrometry Data"

    Presented by Mathew Thomas, Pacific Northwest National Laboratory

    Friday, January 20, 2017, 11 am
    Seminar Room, Bldg. 725

    Hosted by: Kerstin Kleese van Dam

    The current analysis pipeline for Nano-DESI Mass Spectral Imaging involves analyzing the data coming off the instrument using an in-house tool called MSI QuickView and saving the results onto a storage drive before moving on to the next experiment. While this works well for single datasets, there is a demand for more scalable, flexible workflows that are re-executable across datasets, support extensive querying and ease collaboration. His talk will focus on a workflow that moves data analysis from a mere desktop application for single experiments to a more general capability that can be possibly extended to perform multi-modal analysis across datasets. The core components of the workflow include (1) MSI QuickView, a desktop application for the near-real time visualization and analysis of mass spectrometry data; (2) Provenance Environment (ProvEn), a provenance production and collection framework that provides components supporting the production and collection of provenance information for distributed application environments; (3) Elasticsearch, a readily-scalable, broadly-distributable, enterprise-grade search engine that is accessible through an elaborate and extensive API to power extremely fast indexing and searches that support your data discovery applications; (4) Logstash, processing of log files; and (5) Kibana, a platform to visualize, analyze and explore data from multiple sources including Elasticsearch and Logstash.