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How differnt anions bind to three different host molecules - Answers from DFT study. The weak interactions which held together the anions on cavities is explored using AIM topological analysis.

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This page is a summary of: Elucidating the structures and binding of halide ions bound to cucurbit[6]uril, hemi-cucurbit[6]uril and bambus[6]uril using DFT calculations, RSC Advances, January 2011, Royal Society of Chemistry,
DOI: 10.1039/c1ra00266j.
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