{"id":"W2953197231","doi":"10.1002/chin.201652448","title":"ChemInform Abstract: Anion Recognition in Solution via Halogen Bonding","year":2016,"lang":"en","type":"article","venue":"ChemInform","topic":"Crystallography and molecular interactions","field":"Chemistry","cited_by":0,"is_retracted":false,"has_abstract":true,"ca_institutions":"University of Toronto","funders":"","keywords":"Chemistry; Halogen; Halogen bond; Ion; Nanotechnology; Computational chemistry; 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":"codex-gemma-dda1882f352a","candidate_categories":["insufficient_payload"],"consensus_categories":[],"category_scores_codex":[0.0001245597,0.0001749999,0.0001389027,0.0001317226,0.00007280478,0.00002811865,0.0001334074,0.0002154567,0.003680673],"category_scores_gemma":[0.00008539316,0.000149033,0.0001427753,0.0001513536,0.00005444544,0.0004923693,0.00004734223,0.0001718073,0.0001201324],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0002483532,"about_ca_system_score_gemma":0.00002943487,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.00007488288,"about_ca_topic_score_gemma":0.00008811691,"domain_scores_codex":[0.9989177,4.824079e-8,0.0003661261,0.0002109502,0.0001647044,0.0003404575],"domain_scores_gemma":[0.9994326,0.00005093581,0.0001255367,0.0002389553,0.00006083851,0.00009115638],"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":[0.00002854494,0.00003437132,0.0000598105,0.00004290971,0.00001282324,0.000005266241,0.0001084374,1.759917e-8,0.5278082,0.0000361701,0.001765375,0.4700981],"study_design_scores_gemma":[0.0006282711,0.000009399802,0.0003587698,0.0002413398,0.00001350098,0.00005304446,0.0001621223,0.000005393319,0.9307393,0.0004190404,0.06711892,0.0002509318],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"other","genre_gemma":"empirical","genre_scores_codex":[0.09799444,0.00004283248,0.00001583717,0.0001847767,0.000121505,0.00007789879,0.00004822198,0.0001273806,0.9013871],"genre_scores_gemma":[0.9871192,0.00004451784,0.00003603972,0.00005046304,0.0001149994,0.00005538304,0.000236469,0.00001851894,0.01232439],"genre_candidate":"empirical","genre_consensus":null,"teacher_disagreement_score":0.8891248,"threshold_uncertainty_score":0.9972301,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.01743853620845895,"score_gpt":0.2402616836800014,"score_spread":0.2228231474715425,"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."}}