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Identification of novel acetylcholinesterase inhibitors designed by pharmacophore-based virtual screening, molecular docking and bioassay
In this study, pharmacophore based 3D QSAR models for human acetylcholinesterase (AChE) inhibitors were generated, with good significance, statistical values (r(2)(training) = 0.73) and predictability (q(2)(training) = 0.67). It was further validated by three methods (Fischer’s test, decoy set and G...
Autores principales: | , , , , , , , , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
Nature Publishing Group UK
2018
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6175823/ https://www.ncbi.nlm.nih.gov/pubmed/30297729 http://dx.doi.org/10.1038/s41598-018-33354-6 |