{"id":"W2944245064","doi":"10.1002/anie.201904817","title":"Halogen Bonding Helicates Encompassing Iodonium Cations","year":2019,"lang":"en","type":"article","venue":"Angewandte Chemie International Edition","topic":"Crystallography and molecular interactions","field":"Chemistry","cited_by":95,"is_retracted":false,"has_abstract":true,"ca_institutions":"","funders":"National Research, Development and Innovation Office; Natural Sciences and Engineering Research Council of Canada; Nemzeti Kutatási Fejlesztési és Innovációs Hivatal; Svenska Forskningsrådet Formas","keywords":"Halogen; Chemistry; Ion; van der Waals force; Crystallography; Solid-state; Halogen bond; Helix (gastropod); Aryl; Nuclear magnetic resonance spectroscopy; Molecule; Stereochemistry; Computational chemistry; Physical chemistry; 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":[0.0001289363,0.0002682423,0.0001907868,0.0000905134,0.0001993203,0.0002696938,0.0001731215,0.0002211683,0.0009835323],"category_scores_gemma":[0.0001829563,0.0001613763,0.0001189735,0.000116768,0.000160148,0.0001933344,0.000182141,0.0002791753,0.000577721],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0003010431,"about_ca_system_score_gemma":0.0002227413,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0003237916,"about_ca_topic_score_gemma":0.0005887978,"domain_scores_codex":[0.9999148,0.00001592944,0.000006857598,0.00002036676,0.00001581974,0.00002614517],"domain_scores_gemma":[0.9998859,0.00001331767,0.00003346669,0.00001605749,0.00001660723,0.0000345755],"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":[0.0001733248,0.00002315937,0.0004018775,0.0000765264,0.000009758306,0.0002575353,0.00008868815,0.001345509,0.9902158,0.001959928,0.0002267936,0.005221121],"study_design_scores_gemma":[0.00002789116,0.0004510027,0.0009259572,0.00001108856,0.00001793077,0.0002093242,0.00004066748,0.001886129,0.9815762,0.0002596488,0.01457736,0.00001687337],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9793326,0.0007674083,0.01281281,0.00008812424,0.00009109233,0.0001110937,0.0002871317,0.0002018363,0.006307829],"genre_scores_gemma":[0.9887918,0.0004938238,0.007097955,0.00006738408,0.00001188427,0.00005705837,0.0002218884,0.00003579684,0.003222462],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.0009835323,"threshold_uncertainty_score":0.003290236,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.01162685752948767,"score_gpt":0.256437865684,"score_spread":0.2448110081545123,"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."}}