Spectral Peak Shape Modeling | Agent Skills Atlas

About this skill

Use when when generating synthetic LC/GC-MS .mzML files from MoNA or HMDB spectral records where you need to compute absolute ground-truth maximum intensity (simins) for each peak while accounting for chromatographic band broadening, peak tailing, and retention-time dispersion.

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Original listing metadata

Original name

spectral-peak-shape-modeling

Original description

Use when when generating synthetic LC/GC-MS .mzML files from MoNA or HMDB spectral records where you need to compute absolute ground-truth maximum intensity (sim_ins) for each peak while accounting for chromatographic band broadening, peak tailing, and retention-time dispersion.

About this listing

Category: Growth & marketing
Reported license: Apache-2.0
Listing language (estimated): English
Review status: Not individually reviewed
Agent compatibility: Atlas installation supports Claude Code, Codex, and Cursor. Skill-specific dependencies and features are checked during setup.