SMD solvation energy
xiaolinpan opened this issue · comments
Thank you for your open-source code. I have a question about AIMNet model. Are SMD solvation energies included in the model?
Hello, SMD solvation energies are not included in the current AIMNet model unfortunately. For more info about this AIMNet model, please check out this preprint: https://chemrxiv.org/engage/chemrxiv/article-details/6525b39e8bab5d2055123f75
Please let us if you have additional questions.
Thank you very much.