Cargando…
Molecular generation by Fast Assembly of (Deep)SMILES fragments
BACKGROUND: In recent years, in silico molecular design is regaining interest. To generate on a computer molecules with optimized properties, scoring functions can be coupled with a molecular generator to design novel molecules with a desired property profile. RESULTS: In this article, a simple meth...
| Autores principales: | , |
|---|---|
| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
Springer International Publishing
2021
|
| Materias: | |
| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8591910/ https://www.ncbi.nlm.nih.gov/pubmed/34775976 http://dx.doi.org/10.1186/s13321-021-00566-4 |