A carregar...
QM-sym, a symmetrized quantum chemistry database of 135 kilo molecules
Applying deep learning methods in materials science research is an important way of solving the time-consuming problems of typical ab initio quantum chemistry methodology, but due to the size of large molecules, large and uncharted fields still exist. Implementing symmetry information can significan...
Na minha lista:
| Publicado no: | Sci Data |
|---|---|
| Main Authors: | , , , |
| Formato: | Artigo |
| Idioma: | Inglês |
| Publicado em: |
Nature Publishing Group UK
2019
|
| Assuntos: | |
| Acesso em linha: | https://ncbi.nlm.nih.gov/pmc/articles/PMC6802082/ https://ncbi.nlm.nih.gov/pubmed/31628326 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1038/s41597-019-0237-9 |
| Tags: |
Adicionar Tag
Sem tags, seja o primeiro a adicionar uma tag!
|