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A physicochemical descriptor-based scoring scheme for effective and rapid filtering of kinase-like chemical space
BACKGROUND: The current chemical space of known small molecules is estimated to exceed 10(60 )structures. Though the largest physical compound repositories contain only a few tens of millions of unique compounds, virtual screening of databases of this size is still difficult. In recent years, the ap...
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| Main Authors: | , , , , , |
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| Formato: | Artigo |
| Idioma: | Inglês |
| Publicado em: |
BioMed Central
2012
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| Assuntos: | |
| Acesso em linha: | https://ncbi.nlm.nih.gov/pmc/articles/PMC3299594/ https://ncbi.nlm.nih.gov/pubmed/22316383 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1186/1758-2946-4-4 |
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