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1. reinvent-scaffold-decorator reinvent-scaffold-decorator Public

   A SMILES-based encoder-decoder architecture for molecular scaffold decoration

   Python 83 36

2. reinvent-randomized reinvent-randomized Public

   Recurrent Neural Network using randomized SMILES strings to generate molecules

   Python 93 32

3. reinvent-gdb13 reinvent-gdb13 Public archive

   A Recurrent Neural Network implementation that uses SMILES strings to generate molecules from GDB-13

   Python 30 17

4. csv_reader csv_reader Public

   A CSV reader made with Ragel

   C++ 1