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Upload best_hyperparameters.md with huggingface_hub

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+ Number of Optuna trials: 25
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+
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+ Best trial objective: 0.5828 (best trial number: 18)
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+
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+ Best hyperparameters:
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+ - learning_rate: 0.0002004749428706299
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+ - warmup_ratio: 0.01
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+ - num_cycles: 2.5
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+
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+ Training arguments:
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+ - output_dir: /mimer/NOBACKUP/groups/naiss2023-6-290/stefano/models//PROTAC-Splitter-EncoderDecoder-lr_cosine-opt25
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+ - learning_rate: 5e-05
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+ - optim: adamw_torch
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+ - lr_scheduler_type: cosine
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+ - lr_scheduler_kwargs: {}
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+ - adam_beta1: 0.9
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+ - adam_beta2: 0.999
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+ - adam_epsilon: 1e-08
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+ - predict_with_generate: True
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+ - generation_config: GenerationConfig {
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+ "max_length": 512,
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+ "max_new_tokens": 512
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+ }
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+
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+ - generation_max_length: 512
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+ - batch_eval_metrics: False
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+ - group_by_length: True
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+ - per_device_train_batch_size: 128
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+ - per_device_eval_batch_size: 64
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+ - gradient_accumulation_steps: 1
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+ - auto_find_batch_size: True
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+ - fp16: True
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+ - fp16_full_eval: True
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+ - half_precision_backend: auto
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+ - use_cpu: False
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+ - dataloader_num_workers: 8
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+ - dataloader_prefetch_factor: None
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+ - max_steps: 10000
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+ - num_train_epochs: -1
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+ - save_steps: 5000
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+ - save_strategy: steps
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+ - eval_steps: 2500
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+ - eval_delay: 5000
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+ - eval_strategy: steps
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+ - save_total_limit: 2
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+ - load_best_model_at_end: True
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+ - metric_for_best_model: all_ligands_equal
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+ - include_inputs_for_metrics: True
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+ - eval_on_start: False
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+ - log_level: debug
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+ - logging_steps: 500
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+ - disable_tqdm: True
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+ - report_to: ['tensorboard']
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+ - save_only_model: False
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+ - push_to_hub: True
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+ - push_to_hub_model_id: PROTAC-Splitter-EncoderDecoder-lr_cosine-opt25
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+ - push_to_hub_organization: ailab-bio
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+ - hub_model_id: ailab-bio/PROTAC-Splitter-EncoderDecoder-lr_cosine-opt25
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+ - hub_strategy: checkpoint
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+ - hub_private_repo: True
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+ - seed: 42
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+ - data_seed: 42
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+ - warmup_steps: 699