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Challenges, Applications, and Recent Advances of Protein-Ligand Docking in Structure-Based Drug Design

The docking methods used in structure-based virtual database screening offer the ability to quickly and cheaply estimate the affinity and binding mode of a ligand for the protein receptor of interest, such as a drug target. These methods can be used to enrich a database of compounds, so that more co...

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Библиографические подробности
Опубликовано в: :Molecules
Главные авторы: Grinter, Sam Z., Zou, Xiaoqin
Формат: Artigo
Язык:Inglês
Опубликовано: MDPI 2014
Предметы:
Online-ссылка:https://ncbi.nlm.nih.gov/pmc/articles/PMC6270832/
https://ncbi.nlm.nih.gov/pubmed/25019558
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.3390/molecules190710150
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