{"id":"W2951634752","doi":"10.1002/chin.200749236","title":"2D Depiction of Protein—Ligand Complexes.","year":2007,"lang":"en","type":"article","venue":"ChemInform","topic":"Metal complexes synthesis and properties","field":"Medicine","cited_by":3,"is_retracted":false,"has_abstract":true,"ca_institutions":"Computer Research Institute of Montréal","funders":"","keywords":"Chemistry; Depiction; Ligand (biochemistry); Nanotechnology; Combinatorial chemistry; Biochemistry; Linguistics; Receptor","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":[0.0002276592,0.001470046,0.0009348993,0.000957251,0.0009682687,0.001033565,0.001556111,0.002146201,0.08426685],"category_scores_gemma":[0.0003455796,0.0007728047,0.0007748526,0.0008570134,0.0005080085,0.001066829,0.00067253,0.003182925,0.006822217],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.001004252,"about_ca_system_score_gemma":0.0008729625,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.005374074,"about_ca_topic_score_gemma":0.008322903,"domain_scores_codex":[0.9997599,0.00002430199,0.000009671423,0.00004659937,0.0000838005,0.00007584099],"domain_scores_gemma":[0.9997669,0.0001040595,0.00002154622,0.00001758392,0.00003899165,0.00005092939],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"bench_or_experimental","study_design_gemma":"not_applicable","study_design_scores_codex":[0.002861939,0.0004681822,0.001597103,0.003994646,0.000478009,0.004647531,0.0009975173,0.04583775,0.5097839,0.0508402,0.3260551,0.05243791],"study_design_scores_gemma":[0.001000975,0.0005745401,0.01114758,0.0007858486,0.0004845338,0.004291427,0.0009134348,0.3607872,0.1679974,0.02117114,0.4304402,0.0004056831],"study_design_candidate":"not_applicable","study_design_consensus":null,"genre_codex":"other","genre_gemma":"other","genre_scores_codex":[0.2508399,0.03119658,0.2135623,0.03856839,0.009615913,0.0006342362,0.06983335,0.03420045,0.3515488],"genre_scores_gemma":[0.6249561,0.01505949,0.1925727,0.004851392,0.0006445374,0.0009046439,0.03628603,0.002530407,0.1221948],"genre_candidate":"other","genre_consensus":"other","teacher_disagreement_score":0.08426685,"threshold_uncertainty_score":0.2819006,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.04273387602029904,"score_gpt":0.2699934239675291,"score_spread":0.2272595479472301,"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."}}