ecfp

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• marcocolangelo / MSSGAT

  Molecular substructure graph attention network for molecular property identification in drug discovery. This is the starting point for my thesis project and is the fork of a repository from the paper https://doi.org/10.1016/j.patcog.2022.108659

  bioinformaticsembeddings-similaritygnngraph-attention-networksgrumolecular-structurestree-decompositionsecfp
  Language:Python 0