A LSTM to predict AlogP values,measure of molecular hydrophobicity (lipophilicity), from SMILES formulae, works on ChEMBL data
quantumfx/chembl_smiles
A LSTM to predict AlogP values from SMILES formulae, works on ChEMBL data
PythonGPL-3.0
A LSTM to predict AlogP values from SMILES formulae, works on ChEMBL data
PythonGPL-3.0