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Scaffold Topologies II: Analysis of Chemical Databases
We have systematically enumerated graph representations of scaffold topologies for up to 8-ring molecules and 4-valence atoms, thus providing coverage of the lower portion of the chemical space of small molecules (Pollock et al.(1)). Here, we examine scaffold topology distributions for several datab...
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| Main Authors: | , , , , , |
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| Formato: | Artigo |
| Idioma: | Inglês |
| Publicado: |
2008
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| Assuntos: | |
| Acceso en liña: | https://ncbi.nlm.nih.gov/pmc/articles/PMC2807378/ https://ncbi.nlm.nih.gov/pubmed/18605681 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/ci700342h |
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