Article-Journal

Zinc metallo-beta-lactamase from Bacteroides fragilis: A quantum chemical study on model systems of the active site
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Ammonolysis and aminolysis of beta-lactams: A theoretical study
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Competition between Wolff rearrangement and 1,2-hydrogen shift in beta-oxy-alpha-ketocarbenes: Electrostatic and specific solvent effects
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Contribution of pyrone-type structures to carbon basicity: An ab initio study
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Contribution of pyrone-type structures to carbon basicity: Theoretical evaluation of the pK(a) of model compounds
Importance of a synperiplanar stepwise mechanism through neutral intermediates in the aminolysis of monocyclic beta-lactams: A theoretical analysis
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Ionic properties of perovskites derived from topological analysis of their wave function
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NH3-assisted ammonolysis of beta-lactams: A theoretical study
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Non-nuclear Maxima of the Electron Density
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Strategies for determining and using ab initio interionic potentials
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