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Molecular Complexity Calculated by Fractal Dimension
Molecular complexity is an important characteristic of organic molecules for drug discovery. How to calculate molecular complexity has been discussed in the scientific literature for decades. It was known from early on that the numbers of substructures that can be cut out of a molecular graph are of...
Autores principales: | von Korff, Modest, Sander, Thomas |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
Nature Publishing Group UK
2019
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6353876/ https://www.ncbi.nlm.nih.gov/pubmed/30700728 http://dx.doi.org/10.1038/s41598-018-37253-8 |
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