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Molecular Graph Generation by Decomposition and Reassembling
[Image: see text] Designing molecular structures with desired chemical properties is an essential task in drug discovery and materials design. However, finding molecules with the optimized desired properties is still a challenging task due to combinatorial explosion of the candidate space of molecul...
| Autores principales: | , |
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
American Chemical Society
2023
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| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10249382/ https://www.ncbi.nlm.nih.gov/pubmed/37305268 http://dx.doi.org/10.1021/acsomega.3c01078 |