{"id":"W2063746709","doi":"10.1021/jm900291j","title":"Molecular and Conformational Determinants of Pituitary Adenylate Cyclase-Activating Polypeptide (PACAP) for Activation of the PAC1 Receptor","year":2009,"lang":"en","type":"article","venue":"Journal of Medicinal Chemistry","topic":"Neuropeptides and Animal Physiology","field":"Neuroscience","cited_by":78,"is_retracted":false,"has_abstract":true,"ca_institutions":"Institut National de la Recherche Scientifique","funders":"Région Normandie; Agence Nationale de la Recherche","keywords":"Chemistry; Pharmacophore; Receptor; Adenylate kinase; Stereochemistry; Biophysics; Ligand (biochemistry); Biochemistry","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":[0.0001643369,0.0001708472,0.0001417944,0.00006524582,0.0001029005,0.0001548358,0.000157293,0.0001917247,0.001470402],"category_scores_gemma":[0.000230587,0.00009916105,0.0001421349,0.0000544297,0.0001769826,0.0001777765,0.00009334831,0.0004298816,0.0003420614],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0002156194,"about_ca_system_score_gemma":0.0002013364,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0002640777,"about_ca_topic_score_gemma":0.000364322,"domain_scores_codex":[0.9999394,0.0000181022,0.000002574769,0.000007143514,0.00001487664,0.00001777867],"domain_scores_gemma":[0.9999362,0.00002209442,0.00001281066,0.000004582398,0.00000670813,0.0000177139],"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":[0.0003203093,0.00004180193,0.0001653434,0.00003790366,0.000003277111,0.0001456666,0.00002015215,0.0009653234,0.9960209,0.0004820246,0.00007367141,0.001723539],"study_design_scores_gemma":[0.0001479315,0.001394756,0.005522909,0.00001472437,0.00002346554,0.0008636346,0.00007296538,0.006687447,0.9808384,0.0004997166,0.003914855,0.00001921649],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9936598,0.001206788,0.002426555,0.0001949655,0.00002334641,0.00003982487,0.0001295897,0.00001392059,0.002305195],"genre_scores_gemma":[0.9957366,0.0007989731,0.00241995,0.00008869744,0.00001562632,0.00002308277,0.000245436,0.000005452219,0.0006660136],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.001470402,"threshold_uncertainty_score":0.004918933,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.0186633185786246,"score_gpt":0.2689748209604764,"score_spread":0.2503115023818518,"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."}}