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SMILES-based CharLSTM with finetuning and goal-directed generation via policy gradient

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Smiles LSTM

With fine-tuning

  1. Train on ChEMBL 28
  2. Fine-tune on user-provided set of molecules

Draws from this GitHub repo and the associated Medium post

WORK IN PROGRESS

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SMILES-based CharLSTM with finetuning and goal-directed generation via policy gradient

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