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1. pKa-ANI pKa-ANI Public

   Accurate prediction of protein pKa with representation learning

   Python 43 10

2. Auto3D_pkg Auto3D_pkg Public

   Auto3D generates low-energy conformers from SMILES/SDF

   Python 177 37

3. aimnetcentral aimnetcentral Public

   Python 36 15

4. RSE_Atlas RSE_Atlas Public

   Python 3