dataset: name: pl path: ./data/pdbbind_pocket10 split: ./data/split_by_name.pt model: checkpoint: ./checkpoints/pretrained.pt hidden_channels: 256 random_alpha: False sample: seed: 2024 num_samples: 100 num_retry: 5 max_steps: 12 batch_size: 10 num_workers: 4 n_samples: 5