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Representation of target-bound drugs by computed conformers: implications for conformational libraries
BACKGROUND: The increasing number of known protein structures provides valuable information about pharmaceutical targets. Drug binding sites are identifiable and suitable lead compounds can be proposed. The flexibility of ligands is a critical point for the selection of potential drugs. Since comput...
Autores principales: | , , , , |
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Formato: | Texto |
Lenguaje: | English |
Publicado: |
BioMed Central
2006
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC1523373/ https://www.ncbi.nlm.nih.gov/pubmed/16764718 http://dx.doi.org/10.1186/1471-2105-7-293 |