{"id":"W2552357585","doi":"10.1126/science.aag0246","title":"Coordination-induced weakening of ammonia, water, and hydrazine X–H bonds in a molybdenum complex","year":2016,"lang":"en","type":"article","venue":"Science","topic":"Metalloenzymes and iron-sulfur proteins","field":"Energy","cited_by":242,"is_retracted":false,"has_abstract":true,"ca_institutions":"","funders":"Basic Energy Sciences; Natural Sciences and Engineering Research Council of Canada; Office of Science; U.S. Department of Energy","keywords":"Ammonia; Chemistry; Molybdenum; Hydrogen bond; Molecule; Bond cleavage; Hydrazine (antidepressant); Inorganic chemistry; Electrochemistry; Crystallography; Physical chemistry; Organic chemistry; Catalysis; Electrode","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":[0.00009638793,0.0001452253,0.0001579975,0.00007237053,0.0001502229,0.0002011884,0.0002751075,0.0001907957,0.0004396487],"category_scores_gemma":[0.0001722044,0.0001149312,0.00009322466,0.00007957005,0.0002173788,0.0001611576,0.0002385292,0.0002838338,0.0000752421],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0002070367,"about_ca_system_score_gemma":0.0001050707,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0003424942,"about_ca_topic_score_gemma":0.0005119553,"domain_scores_codex":[0.9999212,0.00001026717,0.000005351413,0.00001784939,0.00002736183,0.00001793914],"domain_scores_gemma":[0.9999566,0.000008914376,0.00001598338,0.000005079229,0.000004173679,0.00000921902],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"bench_or_experimental","study_design_gemma":"bench_or_experimental","study_design_scores_codex":[0.00007572368,0.00001610773,0.0002686669,0.00007452965,0.00001102258,0.0001045239,0.00004554486,0.0002182268,0.9972306,0.0003710487,0.00005841253,0.001525586],"study_design_scores_gemma":[0.00002337572,0.0001700992,0.001118333,0.00000272497,0.000006192356,0.00008705568,0.00001592454,0.001050638,0.9962213,0.00005778511,0.001242265,0.000004361231],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9982969,0.0002401083,0.0007068312,0.00004588678,0.000009469614,0.000006302531,0.00001641191,0.00002343998,0.0006547099],"genre_scores_gemma":[0.9987948,0.0001251397,0.0006908008,0.00001868625,0.000003530645,0.000005356816,0.000029881,0.000007976199,0.0003237039],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.0004396487,"threshold_uncertainty_score":0.001502156,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.02539163279695242,"score_gpt":0.2576252494236199,"score_spread":0.2322336166266674,"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."}}