Cargando…
An Imbalance in the Force: The Need for Standardized Benchmarks for Molecular Simulation
[Image: see text] Force fields (FFs) for molecular simulation have been under development for more than half a century. As with any predictive model, rigorous testing and comparisons of models critically depends on the availability of standardized data sets and benchmarks. While such benchmarks are...
| Autores principales: | , , , , |
|---|---|
| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
American Chemical Society
2023
|
| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9875315/ https://www.ncbi.nlm.nih.gov/pubmed/36630710 http://dx.doi.org/10.1021/acs.jcim.2c01127 |