{"id":"W2327697975","doi":"10.3390/cryst6040037","title":"Isomorphous Crystals from Diynes and Bromodiynes Involved in Hydrogen and Halogen Bonds","year":2016,"lang":"en","type":"article","venue":"Crystals","topic":"Crystallography and molecular interactions","field":"Chemistry","cited_by":4,"is_retracted":false,"has_abstract":true,"ca_institutions":"Université de Sherbrooke; Cégep de Sherbrooke","funders":"","keywords":"Crystallography; Isostructural; Hydrogen bond; Diacetylene; Supramolecular chemistry; Halogen bond; Halogen; Chemistry; Moiety; Antiparallel (mathematics); Alkyne; Intermolecular force; Stereochemistry; Molecule; Crystal structure; Polymer; Organic chemistry; Polymerization","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":[0.0001288768,0.0002550383,0.0003649533,0.0002068713,0.0002348546,0.0004926933,0.0005326328,0.000289087,0.00275439],"category_scores_gemma":[0.0003283074,0.0002681725,0.0000963362,0.0004390359,0.0002421929,0.0002215564,0.0001885494,0.0008988737,0.0002813728],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.000593688,"about_ca_system_score_gemma":0.0004352008,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.003382346,"about_ca_topic_score_gemma":0.004216291,"domain_scores_codex":[0.9998091,0.00001870612,0.00001389291,0.00004036358,0.00007215032,0.0000458416],"domain_scores_gemma":[0.999851,0.000025732,0.00003082129,0.00002282514,0.0000381671,0.00003143716],"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":[0.0009767024,0.0001989931,0.001359896,0.0003955206,0.00005353743,0.001083012,0.0003610152,0.004808507,0.9677678,0.008369953,0.003140264,0.01148483],"study_design_scores_gemma":[0.0007618898,0.0008110352,0.01053703,0.00006759677,0.0000710742,0.0007897082,0.000409899,0.01812193,0.9393131,0.001011493,0.0280683,0.00003700315],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9843215,0.0005140229,0.001557466,0.0001663906,0.00006182642,0.00005061462,0.002337436,0.00007823198,0.01091253],"genre_scores_gemma":[0.9868081,0.0005041383,0.005995364,0.00003603816,0.000007159192,0.00007920397,0.002414559,0.00006124554,0.004094059],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.003382346,"threshold_uncertainty_score":0.009214342,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.01244345105384048,"score_gpt":0.22776097059123,"score_spread":0.2153175195373895,"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."}}