{"id":"W63632479","doi":"10.1021/ja040946z","title":"ACD/HNMR Predictor and ACD/CNMR Predictor Advanced Chemistry Development, Inc. (ACD/Labs), 90 Adelaide Street West, Suite 600, Toronto, ON M5H 2V9, Canada. www.acdlabs.com. See Web site for pricing information.","year":2005,"lang":"en","type":"article","venue":"Journal of the American Chemical Society","topic":"Analytical Chemistry and Chromatography","field":"Chemistry","cited_by":10,"is_retracted":false,"has_abstract":true,"ca_institutions":"","funders":"","keywords":"Suite; Web site; Citation; Altmetrics; Library science; World Wide Web; Social media; Computer science; The Internet; Geography; Archaeology","routes":{"ca_aff":false,"ca_fund":false,"ca_venue":false,"about_ca":true,"invisible_to_affiliation_only":true},"retraction":null,"screen":null,"direct_labels":[],"prediction":{"model_version":"metacan-v3-hybrid-931329e0061c","candidate_categories":["insufficient_payload"],"consensus_categories":["insufficient_payload"],"category_scores_codex":[0.003279856,0.001857081,0.002221601,0.002475075,0.001389224,0.003261033,0.002546335,0.001358769,0.4426686],"category_scores_gemma":[0.006287899,0.002048683,0.001285384,0.003235719,0.0005377065,0.003767847,0.001265244,0.003048929,0.3767076],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.002397612,"about_ca_system_score_gemma":0.006380256,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.009137399,"about_ca_topic_score_gemma":0.01719598,"domain_scores_codex":[0.9968851,0.0003201689,0.0001274921,0.0004684198,0.002015438,0.0001832842],"domain_scores_gemma":[0.9950191,0.0006658059,0.0003694087,0.0006414668,0.002687049,0.0006172656],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"not_applicable","study_design_gemma":"not_applicable","study_design_scores_codex":[0.0001013792,0.00004742303,0.0005939533,0.0004332016,0.00002640207,0.00002831251,0.00002492613,0.0005089624,0.0043229,0.002780875,0.9022979,0.08883371],"study_design_scores_gemma":[0.00008822021,0.00007032442,0.0009437114,0.00005907482,0.00003551837,0.0001186731,0.0000243527,0.005962085,0.009888761,0.001486193,0.9812748,0.00004832968],"study_design_candidate":"not_applicable","study_design_consensus":"not_applicable","genre_codex":"other","genre_gemma":"other","genre_scores_codex":[0.006552926,0.01109223,0.1504846,0.008692894,0.003938331,0.001600375,0.1053284,0.2145905,0.4977197],"genre_scores_gemma":[0.02225851,0.01131655,0.1849545,0.002180541,0.0008936679,0.001573219,0.1551843,0.02731558,0.5943231],"genre_candidate":"other","genre_consensus":"other","teacher_disagreement_score":0.5573314,"threshold_uncertainty_score":0.7949656,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.003928533160128879,"score_gpt":0.2089172664190596,"score_spread":0.2049887332589308,"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."}}