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Continuum and discrete calculation of fractional contributions to solvation free energy |
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| Authors: | Morreale Antonio Gelpí Josep Lluis Luque F Javier Orozco Modesto |
| Affiliation: | Institut de Recerca Biomèdica, Parc Científic de Barcelona, Josep Samitier 1-5, Barcelona 08028, Spain. |
| Abstract: | |
| Keywords: | continuum models discrete models solvation fractional solvation |
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