| # --------------------------------------------------------------------------- | |
| # Preset configurations for the unified pipeline entry | |
| # --------------------------------------------------------------------------- | |
| PRESETS = { | |
| "preview": { | |
| "N_max_runs": 1, | |
| "target_template_rmsd_thres": 2.0, | |
| "N_sample": 100, | |
| "N_step": 400, | |
| "return_topk": 5, | |
| "extended_w_af2": 0.5, | |
| "extended_w_ptx": 0.5, | |
| "early_stop": True, | |
| "min_early_stop_rounds": 0, | |
| "min_early_stop_successes": 1, | |
| }, | |
| "extended": { | |
| "N_max_runs": 1, | |
| "target_template_rmsd_thres": 2.0, | |
| "N_sample": 500, | |
| "N_step": 400, | |
| "return_topk": 5, | |
| "extended_w_af2": 0.5, | |
| "extended_w_ptx": 0.5, | |
| "early_stop": True, | |
| "min_early_stop_rounds": 0, | |
| "min_early_stop_successes": 1, | |
| }, | |
| } | |