{"id":"W3094390052","doi":"10.3390/m1161","title":"6-Bromo-N-(3-(difluoromethyl)phenyl)quinolin-4-amine","year":2020,"lang":"en","type":"article","venue":"Molbank","topic":"Synthesis and Reactions of Organic Compounds","field":"Chemistry","cited_by":2,"is_retracted":false,"has_abstract":true,"ca_institutions":"","funders":"Novartis Pharma; University of North Carolina at Chapel Hill; Ministero dello Sviluppo Economico; Fundação de Amparo à Pesquisa do Estado de São Paulo; University of Southampton; European Federation of Pharmaceutical Industries and Associations; Merck KGaA; Ontario Ministry of Economic Development and Innovation; Engineering and Physical Sciences Research Council; Genome Canada; Pfizer","keywords":"Chemistry; Aniline; Molecule; Amine gas treating; Ring (chemistry); Crystallography; Stereochemistry; Organic chemistry","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":[0.0003328755,0.000504391,0.0003548649,0.0003707452,0.0002829914,0.0001545948,0.0008627858,0.000295835,0.00955669],"category_scores_gemma":[0.0001790406,0.0001819015,0.0001918009,0.0002531762,0.0001839329,0.0003066056,0.0002757575,0.0003304897,0.005432134],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0002473444,"about_ca_system_score_gemma":0.0003983913,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0006204752,"about_ca_topic_score_gemma":0.001225236,"domain_scores_codex":[0.9998178,0.00002901475,0.00001209216,0.00004851531,0.00003816227,0.00005449388],"domain_scores_gemma":[0.9999132,0.00001654712,0.00001518178,0.00002408903,0.00001682558,0.00001418633],"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":[0.0004223911,0.0001058967,0.0001948144,0.0003420208,0.00001101944,0.0002901979,0.00004890756,0.000265561,0.9814147,0.001096027,0.0008130911,0.01499537],"study_design_scores_gemma":[0.0002263723,0.002334886,0.003472037,0.00004232466,0.00003320546,0.001149915,0.00005163037,0.0009972664,0.9106044,0.0002422842,0.08080129,0.00004432761],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.8111857,0.01198919,0.08483533,0.0007023762,0.0006773623,0.001569201,0.01065714,0.003138551,0.07524509],"genre_scores_gemma":[0.9474953,0.004599998,0.02418086,0.0001853998,0.00007112712,0.0003648134,0.003116688,0.0001512175,0.01983452],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.00955669,"threshold_uncertainty_score":0.03197026,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.02618355617964584,"score_gpt":0.2136219106519363,"score_spread":0.1874383544722905,"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."}}