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Items where Author is "De Proft, Frank"

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Oláh, Julianna and van Bergen, Laura and De Proft, Frank and Roos, Goedele (2015) How does the protein environment optimize the thermodynamics of thiol sulfenylation? Insights from model systems to QM/MM calculations on human 2-Cys peroxiredoxin. JOURNAL OF BIOMOLECULAR STRUCTURE & DYNAMICS, 33 (3). pp. 584-596. ISSN 0739-1102

Vanpoucke, Danny E. P. and Oláh, Julianna and De Proft, Frank and Van Speybroeck, Veronique and Roos, Goedele (2015) On the Convergence of Atomic Charges with the Size of the Enzymatic Environment. JOURNAL OF CHEMICAL INFORMATION AND MODELING, 55 (3). pp. 564-571. ISSN 1549-9596

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