{"id":"W4408340050","doi":"10.1021/acs.cgd.4c01532","title":"A Bis-Imidazolium Receptor for the Selective Crystallization of Fluoride through Hydrogen Bonding","year":2025,"lang":"en","type":"article","venue":"Crystal Growth & Design","topic":"Fluorine in Organic Chemistry","field":"Pharmacology, Toxicology and Pharmaceutics","cited_by":2,"is_retracted":false,"has_abstract":true,"ca_institutions":"","funders":"Queen's University; Queen's University Belfast","keywords":"Hydrogen bond; Crystallization; Fluoride; Chemistry; Hydrogen fluoride; Combinatorial chemistry; Polymer chemistry; Organic chemistry; Inorganic chemistry; Molecule","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":"codex-gemma-dda1882f352a","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.000791574,0.0002744145,0.0003229427,0.00007827487,0.0003805535,0.0000226422,0.0004851964,0.0003493252,0.0002937212],"category_scores_gemma":[0.0007816941,0.0002376639,0.000162422,0.0007024741,0.0002716831,0.0001426943,0.000118857,0.0004576707,0.000008506049],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0002077987,"about_ca_system_score_gemma":0.000372362,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.00001517561,"about_ca_topic_score_gemma":0.000002080898,"domain_scores_codex":[0.9982646,0.0002239486,0.0004895012,0.0003915167,0.0001595723,0.0004709252],"domain_scores_gemma":[0.9968728,0.002255157,0.0002221307,0.0002671641,0.0003100437,0.00007274549],"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":[0.0006688059,0.0001511714,0.0005148038,0.0002395687,0.000461059,0.0000020797,0.0006725091,0.0007590917,0.9323671,0.01106344,0.05260957,0.0004908012],"study_design_scores_gemma":[0.001252729,0.00009097595,0.00004054159,0.00003588813,0.0003299701,0.000007491987,0.0002008369,0.002211545,0.9094193,0.005040786,0.0811689,0.000201056],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"methods","genre_gemma":"empirical","genre_scores_codex":[0.185895,0.005551584,0.7673892,0.007206032,0.004090025,0.006182775,0.0003789732,0.0006379117,0.02266856],"genre_scores_gemma":[0.9919134,0.0001238032,0.00302474,0.0006686868,0.0003260785,0.0002706794,0.00003381958,0.00004674458,0.00359206],"genre_candidate":"empirical","genre_consensus":null,"teacher_disagreement_score":0.8060184,"threshold_uncertainty_score":0.9691651,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.08068596415950516,"score_gpt":0.3864342133938097,"score_spread":0.3057482492343045,"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."}}