MDCheck

Scientific software for convergence and statistical assessment of molecular-dynamics simulations.

Software for convergence, statistical-inefficiency and reproducibility assessment in molecular-dynamics simulations.

Public record

Field Current evidence
Status Public release
Public release v1.0.0
Language Python
License MIT, according to the public repository metadata
Citation metadata Repository CITATION.cff reports 1.1.0, dated 2026-09-24
DOI No DOI is listed in the current repository metadata

Version control required

The current public records report v1.0.0 for the PyPI package and latest GitHub release, while the repository CITATION.cff reports 1.1.0 dated 2026-09-24. The two records are shown separately until the project metadata is aligned.

Record note

This page summarizes the public package, repository and citation records. It does not replace the project’s documentation or technical evaluation.

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