rxn4chemistry/rxn_yields

Code complementing our manuscript on the prediction of chemical reaction yields (https://iopscience.iop.org/article/10.1088/2632-2153/abc81d) and data augmentation strategies (https://doi.org/10.26434/chemrxiv.13286741).

语言：Jupyter Notebook · GitHub 星标：142 · Fork：26

在 GitHub 上查看原仓库