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Please cite the following manuscript: Download RIS

@Article {Toney2024ChemRxiv,
          author = {Toney, Jacob W., and St Michel, Roland G. and Garrison, Aaron G. and Kevlishvili, Ilia and Kulik, Heather J.},
          title = {Graph neural networks for predicting metal–ligand coordination of transition metal complexes},
          journal = {ChemRxiv},
          year = {2024},
          url = {http://dx.doi.org/10.26434/chemrxiv-2024-nzk5q},
          doi = {10.26434/chemrxiv-2024-nzk5q},
}