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molecular-properties-calculation

Calculate basic molecular properties from SMILES including molecular weight, formula, atom counts, and exact mass.

SpectrAI-Initiative
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SpectrAI-Initiative
Mis à jour 4/2/2026
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371
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quick start

Installation and usage

Calculate basic molecular properties from SMILES including molecular weight, formula, atom counts, and exact mass.

Installation
$ install --globalskills.sh
Utilisation

Après l'installation, vous pouvez utiliser ce skill en exécutant la commande suivante dans votre terminal :

skills use molecular-properties-calculation