{"id":"W4387909348","doi":"10.1021/acs.cgd.3c00964","title":"Effect of [ <i>n</i> ]-Helicene Length on Crystal Packing","year":2023,"lang":"en","type":"article","venue":"Crystal Growth & Design","topic":"Synthesis and Properties of Aromatic Compounds","field":"Chemistry","cited_by":12,"is_retracted":false,"has_abstract":true,"ca_institutions":"Dalhousie University","funders":"H2020 European Research Council; Natural Sciences and Engineering Research Council of Canada; Royal Society","keywords":"Helicene; Stacking; Molecule; Chemical physics; Chirality (physics); Conjugated system; Organic electronics; Crystal (programming language); Materials science; Nanotechnology; Chemistry; Crystallography; Polymer; Chiral symmetry; Organic chemistry; Physics; Computer science","routes":{"ca_aff":true,"ca_fund":true,"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":["metaepi_narrow"],"consensus_categories":[],"category_scores_codex":[0.0008776017,0.0003103303,0.0004624295,0.0001200014,0.0001467596,0.00006104633,0.0003952554,0.0001377843,0.0005085558],"category_scores_gemma":[0.0004897636,0.0002484685,0.0002140624,0.0002917223,0.0001000895,0.0001069141,0.0001159911,0.0001840175,0.0001435642],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.00005268041,"about_ca_system_score_gemma":0.00004182324,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.00002081379,"about_ca_topic_score_gemma":5.612107e-7,"domain_scores_codex":[0.9981309,0.0001508291,0.0004138091,0.000371013,0.0004828166,0.000450678],"domain_scores_gemma":[0.9975244,0.001648467,0.0001594544,0.0004880546,0.000059906,0.0001197326],"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":[0.0006603255,0.00007890543,0.0005407716,0.0008965526,0.0001235852,0.00004221707,0.0003670909,0.0001013006,0.9708264,0.0001630761,0.008002933,0.01819686],"study_design_scores_gemma":[0.0008492827,0.0006470514,0.0001242706,0.0004671727,0.00006883204,0.00001445121,0.0001113469,0.001273731,0.9926193,0.0004644093,0.003007813,0.0003523358],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9589846,0.0001847599,0.0003862987,0.0001423467,0.0001540667,0.0001894841,0.00002196808,0.0004011161,0.03953535],"genre_scores_gemma":[0.9984865,0.00004062396,0.0002391425,0.00004146056,0.0001809674,0.00004862449,0.00001515357,0.00006623259,0.0008813092],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.03950188,"threshold_uncertainty_score":0.9999968,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.0229080497264275,"score_gpt":0.2419004101901042,"score_spread":0.2189923604636768,"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."}}