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Deep Learning for Deep Chemistry: Optimizing the Prediction of Chemical Patterns
Computational Chemistry is currently a synergistic assembly between ab initio calculations, simulation, machine learning (ML) and optimization strategies for describing, solving and predicting chemical data and related phenomena. These include accelerated literature searches, analysis and prediction...
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| Publicado no: | Front Chem |
|---|---|
| Main Authors: | , |
| Formato: | Artigo |
| Idioma: | Inglês |
| Publicado em: |
Frontiers Media S.A.
2019
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| Assuntos: | |
| Acesso em linha: | https://ncbi.nlm.nih.gov/pmc/articles/PMC6988795/ https://ncbi.nlm.nih.gov/pubmed/32039134 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.3389/fchem.2019.00809 |
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