The code for training the model can be found in GitHub (working on the repo...) the generated high QED dataset can be found at A demonstration web application for this model can be found at . The training dataset of 77 million molecules and calculated properties can be found at Link to traning dataset of 77M molecules. sciencedirect . com / science / article / pii / S0957417423028981 (visited on 05/08/2024).