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Automatic design of decision-tree induction algorithms tailored to flexible-receptor docking data
BACKGROUND: This paper addresses the prediction of the free energy of binding of a drug candidate with enzyme InhA associated with Mycobacterium tuberculosis. This problem is found within rational drug design, where interactions between drug candidates and target proteins are verified through molecu...
Autores principales: | , , , , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
BioMed Central
2012
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3534569/ https://www.ncbi.nlm.nih.gov/pubmed/23171000 http://dx.doi.org/10.1186/1471-2105-13-310 |