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Running
| data/chembl_train.smi filter=lfs diff=lfs merge=lfs -text | |
| data/chembl45_test.pt filter=lfs diff=lfs merge=lfs -text | |
| data/NP_score.pkl.gz filter=lfs diff=lfs merge=lfs -text | |
| data/SA_score.pkl.gz filter=lfs diff=lfs merge=lfs -text | |
| data/akt/akt_train.pt filter=lfs diff=lfs merge=lfs -text | |
| data/akt/AKT1_human_adj.pt filter=lfs diff=lfs merge=lfs -text | |
| data/akt/AKT2_human_adj.pt filter=lfs diff=lfs merge=lfs -text | |
| data/akt/AKT3_human_adj.pt filter=lfs diff=lfs merge=lfs -text | |
| experiments/models/NoTarget/NoTarget-G.ckpt filter=lfs diff=lfs merge=lfs -text | |