Protocol for hit-to-lead optimization of compounds by auto in silico ligand directing evolution (AILDE) approach

Hit-to-lead (H2L) optimization is crucial for drug design, which has become an increasing concern in medicinal chemistry. A virtual screening strategy of auto in silico ligand directing evolution (AILDE) has been developed to yield promising lead compounds rapidly and efficiently. The protocol inclu...

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Detalles Bibliográficos
Autores principales: Mei, Longcan, Wu, Fengxu, Hao, Gefei, Yang, Guangfu
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Elsevier 2021
Materias:
Protocol
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7856476/
https://www.ncbi.nlm.nih.gov/pubmed/33554146
http://dx.doi.org/10.1016/j.xpro.2021.100312

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7856476/
https://www.ncbi.nlm.nih.gov/pubmed/33554146
http://dx.doi.org/10.1016/j.xpro.2021.100312

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