Optimized intermolecular geometries and the corresponding energies of glycine zwitterion hydration sites have been evaluated using ab initio calculations with minimal basis sets and compared with the results of the CNDO/2 method. The first hydration shell of the glycine zwitterion is predicted to consist of five water molecules interacting strongly with the solute.
S. U. Kokpol, P. B. Doungdee, S. V. Hannongbua, B. M. Rode and J. P. Limtrakul, J. Chem. Soc., Faraday Trans. 2, 1988, 84, 1789 DOI: 10.1039/F29888401789
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