{"id":"W2312419403","doi":"10.1016/j.radphyschem.2016.03.003","title":"Investigation of the fine structure around the copper site in copper/zinc superoxide dismutase by XANES combined with ab initio calculations","year":2016,"lang":"en","type":"article","venue":"Radiation Physics and Chemistry","topic":"Metal complexes synthesis and properties","field":"Medicine","cited_by":3,"is_retracted":false,"has_abstract":false,"ca_institutions":"","funders":"National Natural Science Foundation of China; Canadian Light Source","keywords":"Copper; XANES; Zinc; Ab initio; Chemistry; Superoxide dismutase; Inorganic chemistry; Materials science; Spectroscopy; Biochemistry; Organic chemistry; Enzyme; Physics","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":"metacan-v3-hybrid-931329e0061c","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0007072389,0.0008335805,0.001042254,0.0006984949,0.001259667,0.0007942319,0.001574298,0.00102612,0.003423265],"category_scores_gemma":[0.000773915,0.001007592,0.0006383385,0.0006829828,0.0007470933,0.0007950641,0.000591172,0.001347583,0.0003066319],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0009592587,"about_ca_system_score_gemma":0.0007149974,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.004777366,"about_ca_topic_score_gemma":0.005349763,"domain_scores_codex":[0.9997699,0.00005917827,0.000007077441,0.00001940874,0.0001004631,0.00004407064],"domain_scores_gemma":[0.9994702,0.0002694986,0.00005212048,0.00009245208,0.00008612584,0.00002971495],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"simulation_or_modeling","study_design_gemma":"bench_or_experimental","study_design_scores_codex":[0.0005132067,0.0003482023,0.004559917,0.0007044738,0.0001601057,0.000641032,0.0003518361,0.8882133,0.04121612,0.04976906,0.002344772,0.01117801],"study_design_scores_gemma":[0.0001137457,0.00005246465,0.001831379,0.00002386783,0.0000191361,0.00002806198,0.0000760636,0.9866296,0.004256962,0.006248092,0.0007055667,0.00001501782],"study_design_candidate":"bench_or_experimental","study_design_consensus":null,"genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9207662,0.001184831,0.04824794,0.0008922405,0.0001341329,0.0001464315,0.0006667673,0.0005930667,0.02736837],"genre_scores_gemma":[0.9799234,0.0004328724,0.01758606,0.00009064702,0.00003083583,0.0001501303,0.000271718,0.0001111893,0.001403126],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.004777366,"threshold_uncertainty_score":0.01145202,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.01484662205330747,"score_gpt":0.2087862599973079,"score_spread":0.1939396379440004,"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."}}