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Interpretable correlation descriptors for quantitative structure-activity relationships
BACKGROUND: The topological maximum cross correlation (TMACC) descriptors are alignment-independent 2D descriptors for the derivation of QSARs. TMACC descriptors are generated using atomic properties determined by molecular topology. Previous validation (J Chem Inf Model 2007, 47: 626-634) of the TM...
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| Main Authors: | , , |
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| Formato: | Artigo |
| Idioma: | Inglês |
| Publicado em: |
Springer International Publishing
2009
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| Assuntos: | |
| Acesso em linha: | https://ncbi.nlm.nih.gov/pmc/articles/PMC2820500/ https://ncbi.nlm.nih.gov/pubmed/20151000 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1186/1758-2946-1-22 |
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