| # @package _global_ | |
| defaults: | |
| - override /data: cameo22 | |
| - override /model: simplefold | |
| - override /model/architecture: foldingdit_100M | |
| - override /model/sampler: euler_maruyama | |
| - override /model/processor: protein_processor | |
| - override /callbacks: default | |
| - override /trainer: default | |
| load_ckpt_path: artifacts/simplefold_100M.ckpt | |
| seed: 12345 | |
| data: | |
| num_repeats: 1 | |
| filters: | |
| - _target_: onescience.datapipes.boltz_data_pipeline.filter.dynamic.max_residues.MaxResiduesFilter | |
| min_residues: 1 | |
| max_residues: 1000 # filter out T1044 in CASP14 | |
| model: | |
| sampler: | |
| num_timesteps: 500 | |
| t_start: 1e-4 | |
| tau: 0.01 | |
| log_timesteps: True | |
| w_cutoff: 0.99 | |
| processor: | |
| inference_multiplicity: 1 | |