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Optimal Ligand Descriptor for Pocket Recognition Based on the Beta-Shape
Structure-based virtual screening is one of the most important and common computational methods for the identification of predicted hit at the beginning of drug discovery. Pocket recognition and definition is frequently a prerequisite of structure-based virtual screening, reducing the search space o...
| Autores principales: | , , , , |
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
Public Library of Science
2015
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| Materias: | |
| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4383629/ https://www.ncbi.nlm.nih.gov/pubmed/25835497 http://dx.doi.org/10.1371/journal.pone.0122787 |