GloMPO (Globally Managed Parallel Optimization) : a tool for expensive, black-box optimizations, application to ReaxFF reparameterizations

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Authors: Toon Verstraelen; Michael Freitas Gustavo

Journal title: JOURNAL OF CHEMINFORMATICS

Journal number: 17582946

Journal publisher: Chemistry Central

Published year: 2022

DOI identifier: 10.1186/s13321-022-00581-z

ISSN: 1758-2946