Towards an Enrichment Optimization Algorithm (EOA)‐based Target Specific Docking Functions for Virtual Screening

Docking‐based virtual screening (VS) is a common starting point in many drug discovery projects. While ligand‐based approaches may sometimes provide better results, the advantage of docking lies in its ability to provide reliable ligand binding modes and approximated binding free energies, two facto...

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Detalles Bibliográficos
Autores principales: Spiegel, Jacob, Senderowitz, Hanoch
Formato: Online Artículo Texto
Lenguaje:English
Publicado: John Wiley and Sons Inc. 2022
Materias:
Research Articles
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9786651/
https://www.ncbi.nlm.nih.gov/pubmed/35790469
http://dx.doi.org/10.1002/minf.202200034

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9786651/
https://www.ncbi.nlm.nih.gov/pubmed/35790469
http://dx.doi.org/10.1002/minf.202200034

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