{"id":"W2164501621","doi":"10.1023/a:1021903427920","title":"Evaluation of the influence of anisotropic indirect nuclear spin-spin coupling tensors on effective residual dipolar couplings for model peptides","year":2003,"lang":"en","type":"article","venue":"Journal of Biomolecular NMR","topic":"Synthesis and Properties of Aromatic Compounds","field":"Chemistry","cited_by":7,"is_retracted":false,"has_abstract":false,"ca_institutions":"University of Alberta","funders":"Canada Research Chairs","keywords":"Chemistry; Spins; Glycylglycine; Residual dipolar coupling; Macromolecule; Nucleic acid; Magnetic dipole–dipole interaction; Anisotropy; Dipole; Spin (aerodynamics); Crystallography; J-coupling; Nuclear magnetic resonance spectroscopy; Amino acid; Stereochemistry; Physics; Quantum mechanics; Condensed matter physics; Biochemistry","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":[],"consensus_categories":[],"category_scores_codex":[0.001438276,0.0001523649,0.0003771341,0.00008529449,0.0001018723,0.00002404738,0.0003111446,0.00009686543,0.00004925011],"category_scores_gemma":[0.002339044,0.0001055192,0.000265705,0.0001136296,0.0001126059,0.00007411963,0.0000318147,0.0001592473,9.174665e-7],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0001297666,"about_ca_system_score_gemma":0.0002001027,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.00001042515,"about_ca_topic_score_gemma":0.000001199773,"domain_scores_codex":[0.9981349,0.00007677631,0.0005911026,0.0001425374,0.0008953707,0.0001592985],"domain_scores_gemma":[0.9977117,0.0002367776,0.0008819544,0.0003064839,0.0008167147,0.00004639315],"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":[0.0001655099,0.000119278,0.0004749543,0.0001495753,0.000241504,0.000001299696,0.000323369,0.08751734,0.9096403,0.0001022923,0.0001059301,0.001158681],"study_design_scores_gemma":[0.001216959,0.0004166551,0.00201584,0.001165698,0.0004585547,0.00002136156,0.0002726044,0.07359293,0.9193034,0.001198729,0.0001829578,0.0001542704],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9986061,0.0005205483,0.0001826175,0.00006533356,0.00002951136,0.0001949107,0.00001920731,0.000005372271,0.0003763472],"genre_scores_gemma":[0.9979789,0.00002573296,0.001879556,0.0000358763,0.00003489732,0.000006776265,8.377515e-7,0.00002630256,0.00001118295],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.01392441,"threshold_uncertainty_score":0.4302948,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.02248582335170055,"score_gpt":0.2748645832717077,"score_spread":0.2523787599200071,"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."}}