Magnesium and calcium cation–ligand inte
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I. Ortega Blake; A. Leś
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Article
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1981
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John Wiley and Sons
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English
⚖ 730 KB
## Abstract We performed __ab initio__ pseudopotential and CNDO calculations on γ‐aminobutyric acid (GABA) and its Ca^2+^ and Mg^2+^ clathrates. We were particularly interested in the rotational barrier existing between two extreme conformers of GABA and its modification upon metal complexing. We f