{"id":"W4403736432","doi":"10.26434/chemrxiv-2024-3svw7","title":"Differentiation of Repeat Phosphopeptide Isomers Through Metal Interactions in FAIMS","year":2024,"lang":"en","type":"preprint","venue":"ChemRxiv","topic":"Peptidase Inhibition and Analysis","field":"Medicine","cited_by":0,"is_retracted":false,"has_abstract":true,"ca_institutions":"University of Waterloo","funders":"","keywords":"Phosphopeptide; Chemistry; Computer science; Biochemistry; Phosphorylation","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":[0.000212307,0.0004210297,0.0001362695,0.0004648048,0.0001847391,0.000374609,0.0002877399,0.0003748201,0.001398512],"category_scores_gemma":[0.0003385228,0.000161085,0.0001847678,0.0002969919,0.0003320834,0.0003459425,0.0002957585,0.0005387381,0.0003806101],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0002443833,"about_ca_system_score_gemma":0.0001133536,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0005266846,"about_ca_topic_score_gemma":0.000707839,"domain_scores_codex":[0.9998467,0.00001459381,0.000006580931,0.00005483338,0.00004809391,0.00002914076],"domain_scores_gemma":[0.9998535,0.00004222488,0.00004155716,0.00001255417,0.00003300552,0.00001710945],"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":[0.00007415957,0.000005661956,0.0003889011,0.00003545046,0.000007542241,0.00004982924,0.00003822596,0.00007231956,0.99692,0.0001234268,0.0000472218,0.002237434],"study_design_scores_gemma":[0.000002506742,0.00005400071,0.002034727,0.00000509206,0.000008709532,0.0001986375,0.00004791458,0.001336701,0.9949337,0.0001004958,0.001270965,0.000006681754],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9692907,0.001102369,0.02646895,0.0001530272,0.00003881019,0.000037212,0.0006396021,0.0003406486,0.001928607],"genre_scores_gemma":[0.968976,0.0009390265,0.02674001,0.0001093573,0.00002274693,0.00005914436,0.0006680776,0.000114977,0.002370804],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.001398512,"threshold_uncertainty_score":0.004678488,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.03243724923542844,"score_gpt":0.3172214677510101,"score_spread":0.2847842185155816,"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."}}