Microsolvation of the Zn(II) ion in aqueous solution: A hybrid QM/MM MD approach using non-periodic boundary conditions

Chemical Physics Letters - Tập 451 - Trang 53-57 - 2008
Giuseppe Brancato1, Nadia Rega1, Vincenzo Barone1
1Dipartimento di Chimica, Università’Federico II’, Complesso Universitario di Monte S. Angelo, via Cintia, I-80126 Napoli, Italy

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