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Data for "CATpie: A Python tool for quantifying membrane curvature, area, and geometrically faithful normal-line thickness from molecular dynamics simulations"

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Zenodo2026-02-24 更新2026-05-26 收录
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Data package for the CATpie manuscript This record contains the input files (trajectories, coordinate files, and index files) used for the CATpie analyses reported in:"CATpie: A Python tool for quantifying membrane curvature, area, and geometrically faithful normal-line thickness from molecular dynamics simulations". Contents- AllAtomSim/: AAtrajectory.xtc, AAcoordinate.gro, AAindex.ndx- CoarseGrainedSim/: CGtrajectory.xtc, CGcoordinate.gro, CGindex.ndx Notes- CATpie.py, LICENSE, CITATION.cff, and CATpie_logo.png are included for completeness.- The actively maintained software repository is available at: https://github.com/AliAHZanjani/CATpie CitationPlease cite the Zenodo record (this DOI) and the associated manuscript.

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Zenodo
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2026-02-24
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