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Accurate prediction of 11B NMR chemical shift of BODIPYs via machine learning
- Source :
- Physical Chemistry Chemical Physics. 25:9472-9481
- Publication Year :
- 2023
- Publisher :
- Royal Society of Chemistry (RSC), 2023.
-
Abstract
- We present the results of developing a new model based on machine learning methods for predicting the 11B NMR chemical shift of boron-containing dyes.
- Subjects :
- General Physics and Astronomy
Physical and Theoretical Chemistry
Subjects
Details
- ISSN :
- 14639084 and 14639076
- Volume :
- 25
- Database :
- OpenAIRE
- Journal :
- Physical Chemistry Chemical Physics
- Accession number :
- edsair.doi...........71ca2b903fb1e6f3cd049ce359c2a5e0
- Full Text :
- https://doi.org/10.1039/d3cp00253e