Cargando…
Modern Alchemical Free Energy Methods for Drug Discovery Explained
[Image: see text] This Perspective provides a contextual explanation of the current state-of-the-art alchemical free energy methods and their role in drug discovery as well as highlights select emerging technologies. The narrative attempts to answer basic questions about what goes on “under the hood...
| Autor principal: | |
|---|---|
| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
American Chemical Society
2023
|
| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10683484/ https://www.ncbi.nlm.nih.gov/pubmed/38034038 http://dx.doi.org/10.1021/acsphyschemau.3c00033 |