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What is the effective dielectric constant in a β-cyclodextrin cavity? Insights from Molecular Dynamics simulations and QM/MM calculations
Alexandrine Lambert, Violeta Yeguas, Gérald Monard, Manuel F. Ruiz-LópezVolume:
968
Year:
2011
Language:
english
Pages:
77
DOI:
10.1016/j.comptc.2011.05.008
File:
PDF, 1.07 MB
english, 2011