Optimizing active learning for free energy calculations
| Autor: | Thompson, James, Walters, W Patrick, Feng, Jianwen A, Pabon, Nicolas A, Xu, Hongcheng, Maser, Michael, Goldman, Brian B, Moustakas, Demetri, Schmidt, Molly, York, Forrest |
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| Zdroj: | In Artificial Intelligence in the Life Sciences December 2022 2 |
| Databáze: | ScienceDirect |
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