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Apo2ph4: A Versatile Workflow for the Generation of Receptor-based Pharmacophore Models for Virtual Screening

[Image: see text] Pharmacophore models are widely used as efficient virtual screening (VS) filters for the target-directed enrichment of large compound libraries. However, the generation of pharmacophore models that have the power to discriminate between active and inactive molecules traditionally r...

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Detalles Bibliográficos
Autores principales: Heider, Jörg, Kilian, Jonas, Garifulina, Aleksandra, Hering, Steffen, Langer, Thierry, Seidel, Thomas
Formato: Online Artículo Texto
Lenguaje:English
Publicado: American Chemical Society 2022
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9832483/
https://www.ncbi.nlm.nih.gov/pubmed/36526584
http://dx.doi.org/10.1021/acs.jcim.2c00814