A theoretical analysis of a classic example of supramolecular catalysis

Peter Carlqvist, Feliu Maseras

Research output: Contribution to journalArticleResearchpeer-review

49 Citations (Scopus)

Abstract

Computational chemistry is used to study a 1,3-dipolar cycloaddition between an azide and an alkyne inside the macrocycle cucurbit[6]uril, in order to elucidate the catalytic function of a highly efficient supramolecular catalyst. © The Royal Society of Chemistry.
Original languageEnglish
Pages (from-to)748-750
JournalChemical Communications
Issue number7
DOIs
Publication statusPublished - 15 Feb 2007

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