{"id":"W2159306385","doi":"10.1073/pnas.1410105111","title":"Extreme cross-peak 2D spectroscopy","year":2014,"lang":"en","type":"letter","venue":"Proceedings of the National Academy of Sciences","topic":"Spectroscopy and Quantum Chemical Studies","field":"Physics and Astronomy","cited_by":5,"is_retracted":false,"has_abstract":true,"ca_institutions":"University of Toronto","funders":"","keywords":"Spectroscopy; Chemistry; Crystallography; Materials science; Computational biology; Biology; Physics","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":[0.001167804,0.0003089407,0.0003511196,0.0003597737,0.001109297,0.001550156,0.0009530249,0.0054759,0.007517491],"category_scores_gemma":[0.003152405,0.0003027156,0.0002235259,0.0003411205,0.001693932,0.001268286,0.001363471,0.005107101,0.004733014],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.00108255,"about_ca_system_score_gemma":0.0004127371,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0001720789,"about_ca_topic_score_gemma":0.0005579267,"domain_scores_codex":[0.998943,0.0003074291,0.00002642551,0.000153816,0.0004836807,0.0000856096],"domain_scores_gemma":[0.9988865,0.0005937469,0.00005635215,0.0002288699,0.0001407141,0.0000938085],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"not_applicable","study_design_gemma":"bench_or_experimental","study_design_scores_codex":[0.0004975653,0.0001130616,0.001577822,0.0002841601,0.00006061929,0.002188512,0.0001775321,0.001518189,0.05317618,0.1817106,0.6633809,0.09531488],"study_design_scores_gemma":[0.0001239583,0.0001306367,0.001272873,0.0001358076,0.00002019038,0.004209419,0.0001112513,0.02235551,0.05411702,0.2117153,0.7056888,0.0001192273],"study_design_candidate":"bench_or_experimental","study_design_consensus":null,"genre_codex":"commentary","genre_gemma":"empirical","genre_scores_codex":[0.03324411,0.01554849,0.1179273,0.4631743,0.0319615,0.0001065668,0.001083659,0.002490231,0.334464],"genre_scores_gemma":[0.6668585,0.008016118,0.03922292,0.1662939,0.01052308,0.0002688867,0.0008322885,0.0003924365,0.1075918],"genre_candidate":"empirical","genre_consensus":null,"teacher_disagreement_score":0.007517491,"threshold_uncertainty_score":0.02514851,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.05400965921288021,"score_gpt":0.3272515890517642,"score_spread":0.273241929838884,"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."}}