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Merging Ligand-Based and Structure-Based Methods in Drug Discovery: An Overview of Combined Virtual Screening Approaches

Virtual screening (VS) is an outstanding cornerstone in the drug discovery pipeline. A variety of computational approaches, which are generally classified as ligand-based (LB) and structure-based (SB) techniques, exploit key structural and physicochemical properties of ligands and targets to enable...

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Detalles Bibliográficos
Autores principales:	Vázquez, Javier, López, Manel, Gibert, Enric, Herrero, Enric, Luque, F. Javier
Formato:	Online Artículo Texto
Lenguaje:	English
Publicado:	MDPI 2020
Materias:	Review
Acceso en línea:	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7587536/ https://www.ncbi.nlm.nih.gov/pubmed/33076254 http://dx.doi.org/10.3390/molecules25204723

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