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Canonicalizing BigSMILES for Polymers with Defined Backbones
[Image: see text] BigSMILES, a line notation for encapsulating the molecular structure of stochastic molecules such as polymers, was recently proposed as a compact and readable solution for writing macromolecules. While BigSMILES strings serve as useful identifiers for reconstructing the molecular c...
| Autores principales: | , , , , |
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
American Chemical Society
2022
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| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9761857/ https://www.ncbi.nlm.nih.gov/pubmed/36561286 http://dx.doi.org/10.1021/acspolymersau.2c00009 |