{"id":"W2010632792","doi":"10.1016/j.str.2009.03.001","title":"Synergy of NMR, Computation, and X-Ray Crystallography for Structural Biology","year":2009,"lang":"en","type":"article","venue":"Structure","topic":"Enzyme Structure and Function","field":"Materials Science","cited_by":67,"is_retracted":false,"has_abstract":false,"ca_institutions":"","funders":"National Institute of General Medical Sciences; Canadian Institutes of Health Research; National Institutes of Health; Israel National Road Safety Authority","keywords":"Structural biology; Nuclear magnetic resonance spectroscopy; Crystallography; Sulfolobus; Structural genomics; Protein structure; Computational biology; Chemistry; Biology; Archaea; Stereochemistry; Biochemistry","routes":{"ca_aff":false,"ca_fund":true,"ca_venue":false,"about_ca":false,"invisible_to_affiliation_only":true},"retraction":null,"screen":null,"direct_labels":[],"prediction":{"model_version":"codex-gemma-dda1882f352a","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.00005737324,0.0001370775,0.0002160908,0.00008947938,0.0001060563,0.00002271143,0.00009829388,0.000127926,0.00008425189],"category_scores_gemma":[0.00003151402,0.0001037424,0.00005149011,0.000124561,0.0001303108,0.00009510287,0.00001473568,0.00006066279,2.35662e-7],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.000006941819,"about_ca_system_score_gemma":0.00001683239,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.00001382776,"about_ca_topic_score_gemma":0.00001431147,"domain_scores_codex":[0.9992361,0.00003118747,0.0002124793,0.0002544105,0.00007893814,0.0001868743],"domain_scores_gemma":[0.9995428,0.0000481784,0.0001288431,0.0001226202,0.0001105675,0.00004704454],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"bench_or_experimental","study_design_gemma":"theoretical_or_conceptual","study_design_scores_codex":[0.00006716977,0.000002436558,0.0006544459,0.00002953772,0.00001052299,3.178994e-7,0.0001893757,0.0006104185,0.9758202,0.01589758,0.0005219072,0.006196063],"study_design_scores_gemma":[0.002043892,0.001381387,0.1457498,0.00002918549,0.00009807434,0.00005309901,0.0002010216,0.001118653,0.1393976,0.7035716,0.005772729,0.0005830207],"study_design_candidate":"bench_or_experimental","study_design_consensus":null,"genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9896765,0.0003354167,0.008762416,0.0001209368,0.0004904213,0.0001897027,0.0002037536,0.00004721362,0.0001736919],"genre_scores_gemma":[0.9825037,0.000004504043,0.01703635,0.0001853309,0.0001628338,0.000001990437,0.00008605928,0.000006944379,0.00001225675],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.8364227,"threshold_uncertainty_score":0.4230492,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.005882912747327869,"score_gpt":0.2467170022265448,"score_spread":0.240834089479217,"validation_status":"score_only:v0-immature-baseline","note":"Baseline scores from an immature model (maturity gate not passed). Scores rank; they never assert a category."}}