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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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Biomolecular Simulations

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3 results in Keywords: Biomolecular Simulations

Biological and Medicinal Chemistry

SHP-1 Variants Broaden the Understanding of pH-Dependent Activities in Protein Tyrosine Phosphatases

Ruidan Shen, Alfie-Louise Brownless, Nikolas Alansson, Marina Corbella, Shina Caroline Lynn Kamerlin, Alvan Hengge

Version 1 posted 18 January 2024

223

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Biological and Medicinal Chemistry

An Efficient Computational Assay for β-Lactam Antibiotic Breakdown by Class A β-Lactamases

Viivi H. A. Hirvonen, Katharine Hammond, Ewa I. Chudyk, Michael A. L. Limb, James Spencer, Adrian Mulholland, Marc W. van der Kamp

Version 1 posted 24 May 2019

492

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Theoretical and Computational Chemistry

Dynamic Interchange Between Two Protonation States is Characteristic of Active Sites of Cholinesterases

Alexander Zlobin, Ivan Smirnov, Andrey Golovin

Version 1 posted 23 January 2024

184

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