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Formula Prediction

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Predict molecular formula candidates from tandem mass spectra.

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  • Added November 8, 2026
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Security analysis

A100/100

Scanned November 8, 2026

npx -y skills add HolobiomicsLab/asb-skill-collections --skill formula-prediction --agent claude-code

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SKILL.md
---
name: formula-prediction
description: Predict molecular formula candidates from tandem mass spectra.
derived_from:
  - doi: "10.9999/asb-fixture-2"
license_tier: open
provenance_tier: literature
tools:
  - FormulaFixture
techniques:
  - LC-MS
---
# Formula prediction

Rank formulas using the synthetic fragment evidence.

Attribution

HolobiomicsLabView sourceSee grades on GitHubMore from HolobiomicsLab

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