Publications

Christian Stemmer, Nils Hoppe, Benjamin Farnbacher, Ralev Radoslav, and Giuseppe Chiapparino. A metadata crawler for simulation data management. 2021. [PUMA: hpc-computing metadata crawler NFDI4ING extraction] URL

Björn Schembera. Like a rainbow in the dark: metadata annotation for HPC applications in the age of dark data. In Hamid Arabnia (Eds.), The Journal of Supercomputing, 2021. [PUMA: forschungsdaten hpc-computing metadata tools automated] URL

Martin Thomas Horsch, Christoph Niethammer, Gianluca Boccardo, Paola Carbone, Silvia Chiacchiera, Mara Chiricotto, Joshua D. Elliott, Vladimir Lobaskin, Philipp Neumann, Peter Schiffels, Michael A. Seaton, Ilian T. Todorov, Jadran Vrabec, and Welchy Leite Cavalcanti. Semantic Interoperability and Characterization of Data Provenance in Computational Molecular Engineering. Journal of Chemical & Engineering Data, (65)3:1313--1329, American Chemical Society (ACS), December 2019. [PUMA: forschungsdaten hpc-computing metadata ontologie molecularSimulation] URL

Giovanni Pizzi, Andrea Cepellotti, Riccardo Sabatini, Nicola Marzari, and Boris Kozinsky. AiiDA: automated interactive infrastructure and database for computational science. Computational Materials Science, (111):218 - 230, 2016. [PUMA: framework forschungsdaten hpc-computing metadata software reproducibility softwareLizenzMotivation repository] URL