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This poster presents the first results of an interdisciplinary project aiming to develop and share sustainable knowledge necessary to analyze, understand, and use published scientific results to advance reproducibility in multi-messenger astrophysics. Specifically, the project targets breakthrough work associated with the First M87 Event Horizon Telescope (EHT) and delivers recommendations on how the published results of the first black hole can be effectively reproduced. The project has the potential to advance new discovery in multi-messenger astrophysics by providing guidance for generalizing methods and findings from use cases.

Convergence between high-performance computing (HPC) and big data analytics (BDA) is currently an established research area that has spawned new opportunities for unifying the platform layer and data abstractions in these ecosystems. This work presents an architectural model that enables the interoperability of established BDA and HPC execution models, reflecting the key design features that interest both the HPC and BDA communities, and including an abstract data collection and operational model that generates a unified interface for hybrid applications. This architecture can be implemented in different ways depending on the process- and data-centric platforms of choice and the mechanisms put in place to effectively meet the requirements of the architecture. The Spark-DIY platform is introduced in the paper as a prototype implementation of the architecture proposed. It preserves the interfaces and execution environment of the popular BDA platform Apache Spark, making it compatible with any Spark-based application and tool, while providing efficient communication and kernel execution via DIY, a powerful communication pattern library built on top of MPI. Later, Spark-DIY is analyzed in terms of performance by building a representative use case from the hydrogeology domain, EnKF-HGS. This application is a clear example of how current HPC simulations are evolving toward hybrid HPC-BDA applications, integrating HPC simulations within a BDA environment. This work was supported in part by the Spanish Ministry of Economy, Industry and Competitiveness under Grant TIN2016-79637-P(toward Unification of HPC and Big Data Paradigms), in part by the Spanish Ministry of Education under Grant FPU15/00422 TrainingProgram for Academic and Teaching Staff Grant, in part by the Advanced Scientific Computing Research, Office of Science, U.S.Department of Energy, under Contract DE-AC02-06CH11357, and in part by the DOE with under Agreement DE-DC000122495,Program Manager Laura Biven.

Today's scientific applications are increasingly relying on a variety of data sources, storage facilities, and computing infrastructures, and there is a growing demand for data analysis and visualization for these applications. In this context, exploiting Big Data frameworks for scientific computing is an opportunity to incorporate high-level libraries, platforms, and algorithms for machine learning, graph processing, and streaming; inherit their data awareness and fault-tolerance; and increase productivity. Nevertheless, limitations exist when Big Data platforms are integrated with an HPC environment, namely poor scalability, severe memory overhead, and huge development effort. This paper focuses on a popular Big Data framework -Apache Spark- and proposes an architecture to support the integration of highly scalable MPI block-based data models and communication patterns with a map-reduce-based programming model. The resulting platform preserves the data abstraction and programming interface of Spark, without conducting any changes in the framework, but allows the user to delegate operations to the MPI layer. The evaluation of our prototype shows that our approach integrates Spark and MPI efficiently at scale, so end users can take advantage of the productivity facilitated by the rich ecosystem of high-level Big Data tools and libraries based on Spark, without compromising efficiency and scalability.

Nowadays there is a raising interest in bridging the gap between Big Data application models and data-intensive HPC. This work explores the effects that Big Data-inspired paradigms could have in current scientific applications through the evaluation of a real-world application from the hydrology domain. This evaluation led to experience that portrayed the key aspects of the HPC and Big Data paradigms that made them successful in their respective worlds. With this information, we established a research roadmap to build a platform suitable for HPC hybrid applications, with a focus on efficient data management and fault-tolerance.