دورية أكاديمية
Real-time prediction of 1H and 13C chemical shifts with DFT accuracy using a 3D graph neural network.
| العنوان: | Real-time prediction of 1H and 13C chemical shifts with DFT accuracy using a 3D graph neural network. |
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| المؤلفون: | Guan, Yanfei, Shree Sowndarya, S. V., Gallegos, Liliana C., St. John, Peter C., Paton, Robert S. |
| المصدر: | Chemical Science; 9/28/2021, Vol. 12 Issue 36, p12012-12026, 15p |
| قاعدة البيانات: | Complementary Index |
Full Text Finder | تدمد: | 20416520 |
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| DOI: | 10.1039/d1sc03343c |