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idea: substructure fragmenter based on Sharma and King functional groups #222

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idea: substructure fragmenter based on Sharma and King functional groups#222
@JonasSchaub

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@JonasSchaub
JonasSchaub
opened on Mar 30, 2026

see here: https://pubs.acs.org/doi/10.1021/acs.jcim.5c02917

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