{"id":"W2342764411","doi":"10.1107/s1600536808003516","title":"(<i>R</i>)-1-Phenylethanaminium (<i>S</i>)-4-chloromandelate","year":2008,"lang":"he","type":"article","venue":"Acta Crystallographica Section E Structure Reports Online","topic":"Crystal structures of chemical compounds","field":"Chemistry","cited_by":3,"is_retracted":false,"has_abstract":true,"ca_institutions":"Western University","funders":"","keywords":"Crystal structure; Crystallography; Chemistry; Hydrogen bond; Perpendicular; Absolute configuration; Crystal (programming language); Stereochemistry; Molecule; Geometry; Mathematics","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":[0.0000769233,0.0002076786,0.0003214326,0.000093346,0.0001461951,0.0002272619,0.0004564286,0.0001777877,0.002691595],"category_scores_gemma":[0.0001680838,0.00008173642,0.00007989266,0.0001702627,0.0002647813,0.0001679073,0.0003071507,0.0003029928,0.0008869692],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0003421411,"about_ca_system_score_gemma":0.0003746793,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.001071479,"about_ca_topic_score_gemma":0.001487443,"domain_scores_codex":[0.9999094,0.00001531613,0.000003587436,0.00001921021,0.00001672783,0.00003584911],"domain_scores_gemma":[0.9999419,0.000006937351,0.00001758223,0.000006269599,0.000007887895,0.00001951043],"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":[0.000608071,0.00002733274,0.0002398628,0.0001861988,0.00001064654,0.0001085949,0.00003144191,0.000207826,0.9891888,0.0009525875,0.0006364292,0.007802194],"study_design_scores_gemma":[0.0001581892,0.001039309,0.001714678,0.0000256136,0.00002251365,0.0007619913,0.00005926829,0.0006134792,0.9726988,0.000281685,0.02260509,0.00001942748],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.964501,0.003009434,0.006296002,0.0003991194,0.0001717376,0.00006082902,0.000480117,0.0005862456,0.02449557],"genre_scores_gemma":[0.9905681,0.0008148395,0.002490174,0.0001266916,0.00001659572,0.00003172259,0.0002909437,0.00005975823,0.005601088],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.002691595,"threshold_uncertainty_score":0.009004295,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.01089444270113722,"score_gpt":0.2313775623213881,"score_spread":0.2204831196202508,"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."}}