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Publications by Andrés M. Escorcia

QM/MM Study of the Taxadiene Synthase Mechanism

Journal of Computational Chemistry
Computational MathematicsChemistry
2019English

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Insight Into the Reaction Mechanism of Lipoyl Synthase: A QM/MM Study

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Phosphorylation Mechanism of NAcetyllglutamate Kinase, a QM/MM Study

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The Reaction Mechanism of Isopentenyl Phosphate Kinase: A QM/MM Study

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A QM/MM and QM/QM/MM Study of Kerr, Cotton–Mouton and Jones Linear Birefringences in Liquid Acetonitrile

Physical Chemistry Chemical Physics
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QM/MM Study on Cleavage Mechanism Catalyzed by Zika Virus NS2B/NS3 Serine Protease

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QM/MM Study of the Uracil DNA Glycosylase Reaction Mechanism: A Competition Between Asp145 and His148

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Insight Into the Phosphodiesterase Mechanism From Combined QM/MM Free Energy Simulations

FEBS Journal
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2011English

An Investigation of the Catalytic Mechanism of S-Adenosylmethionine Synthetase by QM/MM Calculations

Archives of Biochemistry and Biophysics
BiochemistryMolecular BiologyBiophysics
2009English

Complete Reaction Mechanism of Indoleamine 2,3-Dioxygenase as Revealed by QM/MM Simulations

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2012English

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