Fig. 3

Effect of training data size on the prediction performance of T-data. a Model performance variation with and without RT pre-training. b t-SNE distribution of T-data and RT by ECFP4. c t-SNE distribution of T-data and 1000 training data sampled from DB29-data by ECFP4. d t-SNE distribution of T-data and 4000 training data. e t-SNE distribution of T-data and 8000 training data