Cargando…
LEADD: Lamarckian evolutionary algorithm for de novo drug design
Given an objective function that predicts key properties of a molecule, goal-directed de novo molecular design is a useful tool to identify molecules that maximize or minimize said objective function. Nonetheless, a common drawback of these methods is that they tend to design synthetically unfeasibl...
| Autores principales: | , |
|---|---|
| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
Springer International Publishing
2022
|
| Materias: | |
| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8760751/ https://www.ncbi.nlm.nih.gov/pubmed/35033209 http://dx.doi.org/10.1186/s13321-022-00582-y |