Esterase 2 as a fluorescent biosensor for the detection of organophosphorus compounds: docking and electronic insights from molecular dynamics-Reference-Cited by-同舟云学术

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Esterase 2 as a fluorescent biosensor for the detection of organophosphorus compounds: docking and electronic insights from molecular dynamics

Published:2019-08-01 Issue:17 Volume:45 Page:1432-1436
ISSN:0892-7022
Container-title:Molecular Simulation
language:en
Short-container-title:Molecular Simulation

Author:

Prandi Ingrid G.¹,Ramalho Teodorico C.¹²^ORCID,França Tanos C. C.²³^ORCID

Affiliation:

1. Department of Chemistry, Federal University of Lavras, Lavras, Brazil

2. Department of Chemistry, Faculty of Science, University of Hradec Králové, Hradec Králové, Czech Republic.

3. Laboratory of Molecular Modeling Applied to the Chemical and Biological Defense, Military Institute of Engineering, Rio de Janeiro, Brazil

Publisher

Informa UK Limited

Subject

Condensed Matter Physics,General Materials Science,General Chemical Engineering,Modeling and Simulation,Information Systems,General Chemistry

Link

https://www.tandfonline.com/doi/pdf/10.1080/08927022.2019.1648808

Reference26 articles.

1. Substitution of the Catalytic Metal and Protein PEGylation Enhances Activity and Stability of Bacterial Phosphotriesterase

2. Enzimas degradantes de organofosforados: Base molecular e perspectivas para biorremediação enzimática de agroquímicos

3. Acetylcholinesterase: enzyme structure, reaction dynamics, and virtual transition states

4. New insights on molecular interactions of organophosphorus pesticides with esterases

5. First principles calculations of thermodynamics and kinetic parameters and molecular dynamics simulations of acetylcholinesterase reactivators: can mouse data provide new insights into humans?

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