lucy-ng
•published 2026/03/13
Computer-Assisted Structure Elucidation (CASE) for organic natural products using NMR spectroscopy. Use when the user asks to identify an unknown compound from NMR data, perform structure elucidation, analyze HSQC/HMBC/DEPT/COSY spectra, run dereplication against natural product databases (COCONUT, NMRShiftDB), rank candidate structures by 13C prediction, or determine molecular structure from Bruker NMR data. Requires molecular formula and Bruker-format NMR spectra. The AI agent applies domain intelligence via thin CLI commands through the Bash tool.
📦 Install Skill
Command line install
Install directly with the `skills` CLI.
npx skills add steinbeck/lucy-ng/skillFile Explorer
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