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?"
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- aiida-workgraph Public
Efficiently design and manage flexible workflows with AiiDA, featuring an interactive GUI, checkpoints, provenance tracking, and remote execution capabilities.
- aiida-submission-controller Public
Some classes to help managing large number of submissions, while controlling the maximum number of submissions running at any given time
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