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Biological and Medicinal Chemistry

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Catalysis

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Theoretical and Computational Chemistry

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Working Paper

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Lur Alonso-Cotchico

3 results in Authors: Lur Alonso-Cotchico

Biological and Medicinal Chemistry

Dynamics of Metal Complex Binding in Relation to Catalytic Activity and Selectivity of an Artificial Metalloenzyme

Lara Villarino, Shreyans Chordia, Lur Alonso-Cotchico, Eswar R. Reddem, Andy-Mark Thunnissen, Jean-Didier Maréchal, Gerard Roelfes

Version 1 posted 12 March 2020

695

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Theoretical and Computational Chemistry

OMMProtocol: A Command Line Application to Launch Molecular Dynamics Simulations with OpenMM

Jaime Rodríguez-Guerra Pedregal, Lur Alonso-Cotchico, Lorea Velasco-Carneros, Jean-Didier Maréchal

Version 1 posted 10 September 2018

1,014

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2

Citations

Unexpected Catalytic Activity of the Regulatory Protein QacR

Cora Gutiérrez de Souza, Lur Alonso-Cotchico, Manuela Bersellini, Gerard Roelfes

Version 1 posted 17 July 2020

514

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4

Citations