LeadOp+R: Structure-Based Lead Optimization With Synthetic Accessibility

We previously described a structure-based fragment hopping for lead optimization using a pre-docked fragment database, “LeadOp,” that conceptually replaced “bad” fragments of a ligand with “good” fragments while leaving the core of the ligand intact thus improving the compound's activity. LeadO...

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Detalles Bibliográficos
Autores principales: Lin, Fang-Yu, Esposito, Emilio Xavier, Tseng, Yufeng J.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Frontiers Media S.A. 2018
Materias:
Pharmacology
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5845126/
https://www.ncbi.nlm.nih.gov/pubmed/29556192
http://dx.doi.org/10.3389/fphar.2018.00096

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5845126/
https://www.ncbi.nlm.nih.gov/pubmed/29556192
http://dx.doi.org/10.3389/fphar.2018.00096

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