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IDSS: deformation invariant signatures for molecular shape comparison
BACKGROUND: Many molecules of interest are flexible and undergo significant shape deformation as part of their function, but most existing methods of molecular shape comparison (MSC) treat them as rigid bodies, which may lead to incorrect measure of the shape similarity of flexible molecules. RESULT...
| Autores principales: | , , |
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| Formato: | Texto |
| Lenguaje: | English |
| Publicado: |
BioMed Central
2009
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| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2694795/ https://www.ncbi.nlm.nih.gov/pubmed/19463181 http://dx.doi.org/10.1186/1471-2105-10-157 |