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Identifying molecular structural features by pattern recognition methods
Identification of molecular structural features is a central part of computational chemistry. It would be beneficial if pattern recognition techniques could be incorporated to facilitate the identification. Currently, the quantification of the structural dissimilarity is mainly carried out by root-m...
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
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The Royal Society of Chemistry
2022
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| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9192268/ https://www.ncbi.nlm.nih.gov/pubmed/35765452 http://dx.doi.org/10.1039/d2ra00764a |