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A Comparison between Enrichment Optimization Algorithm (EOA)-Based and Docking-Based Virtual Screening

Virtual screening (VS) is a well-established method in the initial stages of many drug and material design projects. VS is typically performed using structure-based approaches such as molecular docking, or various ligand-based approaches. Most docking tools were designed to be as global as possible,...

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Detalles Bibliográficos
Autores principales: Spiegel, Jacob, Senderowitz, Hanoch
Formato: Online Artículo Texto
Lenguaje:English
Publicado: MDPI 2021
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8744642/
https://www.ncbi.nlm.nih.gov/pubmed/35008467
http://dx.doi.org/10.3390/ijms23010043

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