{"id":"W2211777338","doi":"10.1039/c5ce02282g","title":"Two modes of <i>peri</i>-interaction between an aldehyde group and a carboxylate anion in naphthalaldehydate salts","year":2016,"lang":"en","type":"article","venue":"CrystEngComm","topic":"Crystallography and molecular interactions","field":"Chemistry","cited_by":10,"is_retracted":false,"has_abstract":true,"ca_institutions":"","funders":"Engineering and Physical Sciences Research Council; Royal Society; Royal Society of Chemistry; Trent University; Nottingham Trent University","keywords":"Carboxylate; Aldehyde; Chemistry; Ion; Group (periodic table); Carbon atom; Atom (system on chip); Oxygen atom; Medicinal chemistry; Stereochemistry; Organic chemistry; Molecule; Catalysis","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":[0.0001554083,0.0002028802,0.0002903038,0.0001851156,0.00006325403,0.0000296259,0.0001664301,0.0001169377,0.00008702627],"category_scores_gemma":[0.00003144509,0.000166069,0.0001083153,0.0001403688,0.00009632381,0.000411343,0.00007755448,0.0001907362,0.000001753806],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.00005051701,"about_ca_system_score_gemma":0.00001361978,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0006293087,"about_ca_topic_score_gemma":0.0005269803,"domain_scores_codex":[0.9987525,0.00007641884,0.000399039,0.000363618,0.0001476521,0.0002607363],"domain_scores_gemma":[0.9991032,0.0001417027,0.0001638354,0.0004224158,0.00004682183,0.0001219684],"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":[0.0000905717,0.0001167509,0.02511413,0.00007926094,0.00005741121,0.00001472107,0.0002857816,0.0000114614,0.964864,0.0002888538,0.00001519978,0.009061873],"study_design_scores_gemma":[0.01160491,0.0007151975,0.04078997,0.003446253,0.0003728337,0.0003935011,0.004923834,0.002207489,0.9095169,0.004553134,0.01945791,0.002018053],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9945226,0.000142012,0.0004717786,0.00009690783,0.0000743675,0.00008849378,0.0000947092,0.00006883436,0.004440314],"genre_scores_gemma":[0.9993948,0.00008000566,0.0002397597,0.0000221179,0.00009339527,0.00002794445,0.00004877393,0.0000317829,0.00006136539],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.05534707,"threshold_uncertainty_score":0.6772096,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.01804663507784686,"score_gpt":0.279264716655117,"score_spread":0.2612180815772702,"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."}}