106 citations · 672 across the 28 of their papers we have counts for
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cs.DC2019★ 42 cited
Semantic interoperability and characterization of data provenance in computational molecular engineering
M. T. Horsch, C. Niethammer, G. Boccardo +11
By introducing a common representational system for metadata that describe the employed simulation workflows, diverse sources of data and platforms in computational molecular engin…
cs.DC2013
Computational molecular engineering as an emerging technology in process engineering
Martin Horsch, Christoph Niethammer, Jadran Vrabec +1
The present level of development of molecular force field methods is assessed from the point of view of simulation-based engineering, outlining the immediate perspective for furthe…