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Fragment-based Shape Signatures: a new tool for virtual screening and drug discovery
Since its introduction in 2003, the Shape Signatures method has been successfully applied in a number of drug design projects. Because it uses a ray-tracing approach to directly measure molecular shape and properties (as opposed to relying on chemical structure), it excels at scaffold hopping, and i...
| Autores principales: | , , |
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
Springer Netherlands
2013
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| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3880490/ https://www.ncbi.nlm.nih.gov/pubmed/24366428 http://dx.doi.org/10.1007/s10822-013-9698-7 |