Performance of Force-Field- and Machine Learning-Based Scoring Functions in Ranking MAO-B Protein–Inhibitor Complexes in Relevance to Developing Parkinson’s Therapeutics

Monoamine oxidase B (MAOB) is expressed in the mitochondrial membrane and has a key role in degrading various neurologically active amines such as benzylamine, phenethylamine and dopamine with the help of Flavin adenine dinucleotide (FAD) cofactor. The Parkinson’s disease associated symptoms can be...

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Detalles Bibliográficos
Autores principales: Murugan, Natarajan Arul, Muvva, Charuvaka, Jeyarajpandian, Chitra, Jeyakanthan, Jeyaraman, Subramanian, Venkatesan
Formato: Online Artículo Texto
Lenguaje:English
Publicado: MDPI 2020
Materias:
Article
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7589968/
https://www.ncbi.nlm.nih.gov/pubmed/33081086
http://dx.doi.org/10.3390/ijms21207648

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7589968/
https://www.ncbi.nlm.nih.gov/pubmed/33081086
http://dx.doi.org/10.3390/ijms21207648

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