{"id":"W2166650479","doi":"10.1002/psc.297","title":"Influence of <i>N</i>‐terminal residue stereochemistry on the prolyl amide geometry and the conformation of 5‐<i>tert</i>‐butylproline type VI β‐turn mimics","year":2001,"lang":"en","type":"article","venue":"Journal of Peptide Science","topic":"Chemical Synthesis and Analysis","field":"Biochemistry, Genetics and Molecular Biology","cited_by":22,"is_retracted":false,"has_abstract":true,"ca_institutions":"Université de Montréal","funders":"Natural Sciences and Engineering Research Council of Canada","keywords":"Chemistry; Dihedral angle; Intramolecular force; Conformational isomerism; Acetamide; Hydrogen bond; Amide; Stereochemistry; Turn (biochemistry); Dipeptide; Crystallography; Circular dichroism; Nuclear magnetic resonance spectroscopy; Nuclear Overhauser effect; Amino acid; Molecule; 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":"codex-gemma-dda1882f352a","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.001222904,0.00008924634,0.0001882039,0.00005257266,0.00007739037,0.00002196224,0.0004526026,0.00004809078,0.000006986807],"category_scores_gemma":[0.0007266622,0.00004578417,0.00009153079,0.000316468,0.0008210882,0.00002088374,0.00009318348,0.000129738,4.214444e-7],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.00001082369,"about_ca_system_score_gemma":0.0001096176,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.00001197391,"about_ca_topic_score_gemma":0.000003419019,"domain_scores_codex":[0.9989068,0.00003091457,0.0004424152,0.0001146439,0.000370681,0.0001345403],"domain_scores_gemma":[0.9985899,0.00008417345,0.0006105565,0.0002432362,0.0004145394,0.00005762292],"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":[0.0003112213,0.00002829062,0.002832313,0.00001965021,0.00002270687,0.000001255848,0.0000626279,0.000328084,0.9956531,0.00003412708,0.0000892865,0.0006173605],"study_design_scores_gemma":[0.0003632069,0.0001484805,0.005940985,0.00008752288,0.0000405631,0.0001051928,0.0001183623,0.0002451833,0.9922482,0.0001221421,0.000519415,0.00006074361],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9987013,0.0002775003,0.00004203691,0.0005665107,0.00001610992,0.00005417689,0.000004095698,7.376136e-7,0.0003374734],"genre_scores_gemma":[0.9988471,0.0005686698,0.0001629576,0.0002796541,0.00007116459,8.137376e-7,9.287656e-7,0.000003265527,0.0000654561],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.003404874,"threshold_uncertainty_score":0.3025334,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.006697731517603052,"score_gpt":0.2371420416507978,"score_spread":0.2304443101331947,"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."}}