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Merge pull request #103 from erjank/main
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Candidate statement of need update
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chrisjonesBSU authored Dec 4, 2023
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Expand Up @@ -87,9 +87,10 @@ simulating fusion welding of polymer interfaces

`flowerMD` is a Python package that consolidates and automates
end-to-end workflows for modeling such engineering processes with a focus on organic
molecules. Following the principals of Transparent, Reproducible, Usable by others,
and Extensible (TRUE) [@TRUE_2020] software design, the modular design of `flowerMD`
facilitates building and running workflows for specific materials science research
molecules. We expand the capabilities of MoSDeF [@TRUE_2020] and HOOMD-blue
[@anderson2020hoomd], following TRUE principles of software design (Transparent,
Reproducible, Usable by others, and Extensible [@TRUE_2020]) with modular components that
facilitate building and running workflows for specific materials science research
applications, while reducing the cognitive load and programming demands on the user's part.

# Building Blocks
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