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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...

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Sonraí Bibleagrafaíochta
Foilsithe in:Sci Rep
Main Authors: von Korff, Modest, Sander, Thomas
Formáid: Artigo
Teanga:Inglês
Foilsithe: Nature Publishing Group UK 2019
Ábhair:
Rochtain Ar Líne:https://ncbi.nlm.nih.gov/pmc/articles/PMC6353876/
https://ncbi.nlm.nih.gov/pubmed/30700728
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1038/s41598-018-37253-8
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