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Toward the Understanding of the Metabolism of Levodopa I. DFT Investigation of the Equilibrium Geometries, Acid-Base Properties and Levodopa-Water Complexes

Levodopa (LD) is used to increase dopamine level for treating Parkinson’s disease. The major metabolism of LD to produce dopamine is decarboxylation. In order to understand the metabolism of LD; the electronic structure of levodopa was investigated at the Density Functional DFT/B3LYP level of theory...

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Main Authors: Elroby, Shabaan A. K., Makki, Mohamed S. I., Sobahi, Tariq R., Hilal, Rifaat H.
Format: Artigo
Jezik:Inglês
Izdano: Molecular Diversity Preservation International (MDPI) 2012
Teme:
Online dostop:https://ncbi.nlm.nih.gov/pmc/articles/PMC3344216/
https://ncbi.nlm.nih.gov/pubmed/22605980
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.3390/ijms13044321
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