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MoSGrid: efficient data management and a standardized data exchange format for molecular simulations in a grid environment., , , , , , , , , and 8 other author(s). J. Cheminformatics, 4 (S-1): 21 (2012)Quantum chemical meta-workflows in MoSGrid., , , , , , , , , and 2 other author(s). Concurrency and Computation: Practice and Experience, 27 (2): 344-357 (2015)Towards a metadata-driven multi-community research data management service., , , , , , , , , and 2 other author(s). PeerJ PrePrints, (2017)Gathering requirements for advancing simulations in HPC infrastructures via science gateways., , , , , , and . Future Generation Comp. Syst., (2018)MoSGrid - a molecular simulation grid as a new tool in computational chemistry, biology and material science., , , , , , , , , and 10 other author(s). J. Cheminformatics, 3 (S-1): 14 (2011)Standards-based metadata management for molecular simulations., , , , , , , , , and 8 other author(s). Concurrency and Computation: Practice and Experience, 26 (10): 1744-1759 (2014)Chemical Reactions at Freely Ascending Single Bubbles, , , , , , , , , and 13 other author(s). in: Reactive Bubbly Flows - Final Report of the DFG Priority Program 1740, Springer Nature Switzerland, (2021)The MASi repository service — Comprehensive, metadata-driven and multi-community research data management, , , , , , , , , and 6 other author(s). Future Generation Computer Systems, (2019)Optical response of the Cu2S2 diamond core in Cu2II(NGuaS)2Cl2., , , , , , , , , and 2 other author(s). Journal of Computational Chemistry, 37 (24): 2181-2192 (2016)The Cu2O2 torture track for a real-life system: Cu2(btmgp)2O22+ oxo and peroxo species in density functional calculations., , , , and . Journal of Computational Chemistry, 36 (22): 1672-1685 (2015)