SEAMM: Simulation Environment for Atomistic and Molecular Modeling

Nash, Jessica
Marin-Rimoldi, Eliseo
Saxe, Paul

Publication date

October 2022

DOI

Abstract

Better support for plug-ins and the SEAMM cookiecutter: Automated most handling of results and properties, based on metadata Simplified handling of sub-flowcharts.Funding: NSF OAC-1547580 and CHE-213614

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SEAMM: Simulation Environment for Atomistic and Molecular Modeling

Nash, Jessica
Marin-Rimoldi, Eliseo
Saxe, Paul

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Publication date

October 2022

DOI

10.5281/zenodo.7242355

SEAMM: Simulation Environment for Atomistic and Molecular Modeling

Abstract

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SEAMM: Simulation Environment for Atomistic and Molecular Modeling

Abstract

Extracted data

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