{"id":"W4255285228","doi":"10.1002/ange.201510675","title":"Validating Eaton's Hypothesis: Cubane as a Benzene Bioisostere","year":2016,"lang":"en","type":"article","venue":"Angewandte Chemie","topic":"Cyclopropane Reaction Mechanisms","field":"Chemistry","cited_by":45,"is_retracted":false,"has_abstract":true,"ca_institutions":"Centre for Drug Research and Development","funders":"Australian Research Council","keywords":"Cubane; Bioisostere; Benzene; Chemistry; Molecule; Ring (chemistry); Small molecule; Stereochemistry; Combinatorial chemistry; Organic chemistry; Chemical synthesis; In vitro; Biochemistry","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":"metacan-v3-hybrid-931329e0061c","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.001016809,0.0002819324,0.0002757101,0.0002854377,0.0002835982,0.000580304,0.0004850927,0.0005105141,0.002528243],"category_scores_gemma":[0.0009631087,0.0001351859,0.0001831995,0.0001696573,0.001164545,0.001044781,0.0006883338,0.0008440989,0.000479857],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0004289847,"about_ca_system_score_gemma":0.0004810425,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0009583161,"about_ca_topic_score_gemma":0.0006465794,"domain_scores_codex":[0.9996423,0.0001232022,0.00001803208,0.00005371333,0.00007746309,0.00008539455],"domain_scores_gemma":[0.9994911,0.0002279283,0.00007445855,0.00007580795,0.00008264289,0.0000479582],"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":[0.003016868,0.0004811732,0.003759524,0.0007320213,0.00008035062,0.001391951,0.0004280798,0.005219074,0.8303655,0.1012988,0.002558086,0.0506686],"study_design_scores_gemma":[0.0001170155,0.003571274,0.001493665,0.00006879496,0.00004851018,0.0006744501,0.0003420798,0.006482333,0.9412201,0.01090163,0.03502219,0.00005798439],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9332901,0.006940144,0.02329014,0.003202169,0.0005631027,0.0002493615,0.0003145528,0.0001372511,0.03201332],"genre_scores_gemma":[0.9898483,0.00198915,0.003722736,0.0003835804,0.00003150398,0.00005313521,0.00008852436,0.00001193235,0.003871225],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.002528243,"threshold_uncertainty_score":0.008457839,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.02490319557496792,"score_gpt":0.2377749965832773,"score_spread":0.2128718010083094,"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."}}