Cargando…
Transferring chemical and energetic knowledge between molecular systems with machine learning
Predicting structural and energetic properties of a molecular system is one of the fundamental tasks in molecular simulations, and it has applications in chemistry, biology, and medicine. In the past decade, the advent of machine learning algorithms had an impact on molecular simulations for various...
| Autores principales: | , , , |
|---|---|
| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
Nature Publishing Group UK
2023
|
| Materias: | |
| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9839695/ https://www.ncbi.nlm.nih.gov/pubmed/36697971 http://dx.doi.org/10.1038/s42004-022-00790-5 |