{"id":"W2610653874","doi":"10.1107/s2052252517006042","title":"NMR crystallography: structure and properties of materials from solid-state nuclear magnetic resonance observables","year":2017,"lang":"en","type":"review","venue":"IUCrJ","topic":"Advanced NMR Techniques and Applications","field":"Chemistry","cited_by":168,"is_retracted":false,"has_abstract":true,"ca_institutions":"University of Ottawa","funders":"Natural Sciences and Engineering Research Council of Canada","keywords":"Solid-state nuclear magnetic resonance; Ionic bonding; Complementarity (molecular biology); Solid-state; Observable; Nuclear magnetic resonance crystallography; Materials science; Chemistry; Nuclear magnetic resonance; Nuclear magnetic resonance spectroscopy; Crystallography; Physics; Fluorine-19 NMR; Ion; Physical chemistry; Organic chemistry","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":"metacan-v3-hybrid-931329e0061c","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0007135383,0.0009650762,0.001224656,0.002943065,0.0003984512,0.001500558,0.001130032,0.001400834,0.004742703],"category_scores_gemma":[0.001022407,0.0004590424,0.0003888295,0.002910383,0.001350865,0.002136314,0.0009770185,0.00211304,0.00476265],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0008587852,"about_ca_system_score_gemma":0.001258817,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0009937458,"about_ca_topic_score_gemma":0.001265066,"domain_scores_codex":[0.9996279,0.00006098353,0.00002587285,0.00006227569,0.0001965217,0.00002645826],"domain_scores_gemma":[0.9995469,0.0002248416,0.0000567695,0.00002913097,0.0001132722,0.00002897059],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"design_other","study_design_gemma":"not_applicable","study_design_scores_codex":[0.00004358101,0.0000502378,0.0002912277,0.01405363,0.00005730479,0.0002098644,0.0001392132,0.001081547,0.01374872,0.04423656,0.05034531,0.8757427],"study_design_scores_gemma":[0.000005437036,0.00003219475,0.0003373216,0.001044037,0.00001936082,0.0007420132,0.00004517494,0.0003220935,0.005045788,0.008661224,0.9837127,0.00003267836],"study_design_candidate":"not_applicable","study_design_consensus":null,"genre_codex":"review","genre_gemma":"review","genre_scores_codex":[0.0004010465,0.9874465,0.004095683,0.0007650129,0.0006016371,0.00002018031,0.0001116853,0.00007444841,0.006483943],"genre_scores_gemma":[0.002474743,0.9911976,0.002547511,0.0002765257,0.0007219118,0.00002764562,0.0002318772,0.00002050954,0.002501576],"genre_candidate":"review","genre_consensus":"review","teacher_disagreement_score":0.004742703,"threshold_uncertainty_score":0.01586592,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.0576922142467367,"score_gpt":0.3184041835781957,"score_spread":0.260711969331459,"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."}}