{"id":"W3091163601","doi":"10.1002/anie.202011521","title":"Quantifying Planarity in the Design of Organic Electronic Materials","year":2020,"lang":"en","type":"article","venue":"Angewandte Chemie International Edition","topic":"Organic Electronics and Photovoltaics","field":"Engineering","cited_by":80,"is_retracted":false,"has_abstract":true,"ca_institutions":"McGill University","funders":"","keywords":"Planarity testing; Intramolecular force; Intermolecular force; Conjugated system; Chemical-mechanical planarization; Stacking; Materials science; Catenation; Chemical physics; Band gap; Computational chemistry; Chemistry; Crystallography; Nanotechnology; Molecule; Stereochemistry; Optoelectronics; Polymer; 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":"metacan-v3-hybrid-931329e0061c","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0002787569,0.0002436137,0.0002092976,0.0004024035,0.0001319466,0.0004463971,0.0002077595,0.0001785287,0.0004973872],"category_scores_gemma":[0.0005647404,0.000142681,0.0001061545,0.0003168659,0.0002959424,0.0003849803,0.0003197637,0.0002299014,0.0001480406],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0002908275,"about_ca_system_score_gemma":0.000195289,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0001493377,"about_ca_topic_score_gemma":0.0002978358,"domain_scores_codex":[0.9998773,0.00003055421,0.000006281461,0.00002097584,0.00004711285,0.00001775432],"domain_scores_gemma":[0.999835,0.0000635066,0.00004387092,0.00002007718,0.00002854349,0.00000897017],"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":[0.0001523129,0.00009592548,0.004371139,0.0002705132,0.00005538705,0.00009972721,0.00004065282,0.28488,0.6090323,0.03105531,0.0003291631,0.06961749],"study_design_scores_gemma":[0.0000221403,0.0006598282,0.002459479,0.0000279854,0.00004053178,0.00009360165,0.00007604131,0.5362108,0.4401693,0.01569173,0.004499174,0.00004939993],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.901307,0.001633347,0.09078081,0.0001614023,0.00002386643,0.00005604781,0.0001377881,0.0001996927,0.005699997],"genre_scores_gemma":[0.9827664,0.0004114906,0.0163971,0.0000177135,0.000004571423,0.00002652926,0.00006453853,0.00001702565,0.0002946734],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.0004973872,"threshold_uncertainty_score":0.002110124,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.02860584008435686,"score_gpt":0.239315908015021,"score_spread":0.2107100679306642,"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."}}