A carregar...
Rapid prediction of NMR spectral properties with quantified uncertainty
Accurate calculation of specific spectral properties for NMR is an important step for molecular structure elucidation. Here we report the development of a novel machine learning technique for accurately predicting chemical shifts of both [Formula: see text] and [Formula: see text] nuclei which ex...
Na minha lista:
| Publicado no: | J Cheminform |
|---|---|
| Main Authors: | , |
| Formato: | Artigo |
| Idioma: | Inglês |
| Publicado em: |
Springer International Publishing
2019
|
| Assuntos: | |
| Acesso em linha: | https://ncbi.nlm.nih.gov/pmc/articles/PMC6684566/ https://ncbi.nlm.nih.gov/pubmed/31388784 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1186/s13321-019-0374-3 |
| Tags: |
Adicionar Tag
Sem tags, seja o primeiro a adicionar uma tag!
|