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PROTAC-Degradation-Predictor / src

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History: 18 commits

ribesstefano's picture

Added XGBoost Optuna training + Added Ablation studies with zeroed input vectors

33f1644 9 months ago

collect_checkpoints.py

4.47 kB

Added results with FP normalization removed 9 months ago
plot_experiment_results.py
16.8 kB

Added results with FP normalization removed 9 months ago
run_experiments.py
20.7 kB

Added ablation study with randomly sampled vectors + Started working on LightningDataModule wrapper 10 months ago
run_xgboost_experiments.py

14 kB

Added XGBoost Optuna training + Added Ablation studies with zeroed input vectors 9 months ago