Automated Interactive Infrastructure and Database
AiiDA is an open-source Python infrastructure for managing and tracking complex computational workflows — built for reproducibility, scale, and the long tail of "what did I run six months ago?"
Automated Interactive Infrastructure and Database
AiiDA is an open-source Python infrastructure for managing and tracking complex computational workflows — built for reproducibility, scale, and the long tail of "what did I run six months ago?"
A python workflows library that supports writing Processes with a well defined set of inputs and outputs that can be strung together.
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