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Investigation of chemical structure recognition by encoder–decoder models in learning progress
Descriptor generation methods using latent representations of encoder–decoder (ED) models with SMILES as input are useful because of the continuity of descriptor and restorability to the structure. However, it is not clear how the structure is recognized in the learning progress of ED models. In thi...
| Autores principales: | , , |
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
Springer International Publishing
2023
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| Materias: | |
| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10100163/ https://www.ncbi.nlm.nih.gov/pubmed/37046349 http://dx.doi.org/10.1186/s13321-023-00713-z |