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Computation of protein pK’s values by an integrated density functional theory/Polarizable Continuum Model approach

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Bibliographic Details
Published in:Theoretical chemistry accounts 2004-03, Vol.111 (2-6), p.237-245
Main Authors: Barone, Vincenzo, Improta, Roberto, Rega, Nadia
Format: Article
Language:English
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ISSN:1432-881X
1432-2234
DOI:10.1007/s00214-003-0541-4