{ "default_seeds": [ 42, 123, 456 ], "num_candidates_per_seed": 100, "num_batches": 1, "num_steps": 1500, "warmup_steps": 100, "guidance_strength_beta": 5.0, "top_k": 50, "temperature": 1.0, "position_sampling": "weighted", "use_acceptance": false, "fix_termini": "cooh", "fast_scoring": true, "weights": { "synthetic_accessibility": 4.0, "chemotype_closeness": 2.0, "connectivity": 4.0 }, "weights_positional": [ 4.0, 2.0, 4.0 ], "targets": { "EGFR-VHL": { "protac_module": "ErlotinibVHL", "warhead": "gefitinib-piperazine (MS39)", "e3": "VH032" }, "BRD9-VHL": { "protac_module": "BRD9VHL", "warhead": "BI-7273-piperazine", "e3": "VH032" }, "CDK6-CRBN": { "protac_module": "CDK6CRBN", "warhead": "palbociclib-piperazine", "e3": "pomalidomide" } } }