{"id":"W1987037922","doi":"10.1107/s0108270104019195","title":"1<i>H</i>-Imidazol-1-yl 1,2,3,4-tetrahydroisoquinolin-2-yl ketone","year":2004,"lang":"en","type":"article","venue":"Acta Crystallographica Section C Crystal Structure Communications","topic":"Synthesis and Reactions of Organic Compounds","field":"Chemistry","cited_by":0,"is_retracted":false,"has_abstract":true,"ca_institutions":"University of Toronto","funders":"","keywords":"Hydrogen bond; Chemistry; Ketone; Salt (chemistry); Iodide; Medicinal chemistry; Tetra; Crystal structure; Crystallography; Molecule; Organic chemistry","routes":{"ca_aff":true,"ca_fund":false,"ca_venue":false,"about_ca":false,"invisible_to_affiliation_only":false},"retraction":null,"screen":null,"direct_labels":[],"prediction":{"model_version":"codex-gemma-dda1882f352a","candidate_categories":["metaepi_narrow","sts","insufficient_payload"],"consensus_categories":[],"category_scores_codex":[0.0001753383,0.0005881161,0.0005187515,0.0004976522,0.001664312,0.0002779421,0.002052284,0.0006073779,0.001765148],"category_scores_gemma":[0.0001280031,0.000587845,0.0004844929,0.001375411,0.0007537011,0.0005086635,0.0006264898,0.001362097,0.000003942515],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0004386532,"about_ca_system_score_gemma":0.0002231363,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0004819952,"about_ca_topic_score_gemma":0.001548403,"domain_scores_codex":[0.9970889,0.00007426024,0.0008482801,0.0007515625,0.0005677406,0.0006692252],"domain_scores_gemma":[0.9949435,0.0002745843,0.0004343002,0.003735065,0.0002771992,0.0003353328],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"bench_or_experimental","study_design_gemma":"not_applicable","study_design_scores_codex":[0.00003720783,0.0003935836,0.0005671669,0.00004750091,0.0002694143,0.000003874583,0.0003525114,0.0001422768,0.995043,0.001489518,0.000462588,0.001191401],"study_design_scores_gemma":[0.002073404,0.0001047549,0.005287806,0.0001798827,0.0003044018,0.0009179546,0.001567857,0.0001229738,0.02538124,0.01210828,0.9505353,0.001416168],"study_design_candidate":"bench_or_experimental","study_design_consensus":null,"genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9583645,0.001208709,0.0007944665,0.007247008,0.0007233514,0.0003321241,0.0002647873,0.001231152,0.0298339],"genre_scores_gemma":[0.9944589,0.00119425,0.002940403,0.0001667391,0.0004689997,0.00006999361,0.0003940054,0.0001199843,0.0001866837],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.9696617,"threshold_uncertainty_score":0.9996573,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.01346231810385108,"score_gpt":0.2386882237522174,"score_spread":0.2252259056483663,"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."}}