{"id":"W4234124166","doi":"10.1002/ange.201309436","title":"Discovery of Inhibitors of Shiga Toxin Type 2 by On‐Plate Generation and Screening of a Focused Compound Library","year":2014,"lang":"en","type":"article","venue":"Angewandte Chemie","topic":"Escherichia coli research studies","field":"Biochemistry, Genetics and Molecular Biology","cited_by":4,"is_retracted":false,"has_abstract":true,"ca_institutions":"Alberta Glycomics Centre; University of Alberta","funders":"","keywords":"Chemistry; Combinatorial chemistry; Ligand (biochemistry); Function (biology); Shiga toxin; Toxin; Computational biology; Nanotechnology; Stereochemistry; Escherichia coli; Biochemistry; Materials science; Biology; Receptor; Genetics","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":[0.0004217584,0.001079134,0.0009179483,0.0008058747,0.0002032422,0.0005892136,0.0008309741,0.0004743539,0.002534639],"category_scores_gemma":[0.0003167466,0.0004364511,0.0004345363,0.0005061498,0.0002207726,0.0002480588,0.0003823859,0.0006038555,0.0009449089],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0004770731,"about_ca_system_score_gemma":0.000532647,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0009469471,"about_ca_topic_score_gemma":0.003169478,"domain_scores_codex":[0.9996914,0.00005711975,0.00001321277,0.00004501288,0.0001370472,0.00005625553],"domain_scores_gemma":[0.9998405,0.0000378664,0.00001955998,0.00001902458,0.0000480898,0.00003501472],"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":[0.0001943684,0.00019976,0.0001675029,0.00007956474,0.00002935241,0.00007871566,0.00002192373,0.001192484,0.9887216,0.0001371076,0.0002768599,0.008900695],"study_design_scores_gemma":[0.0001299346,0.002164197,0.0008344919,0.00001182449,0.00005831943,0.0001834027,0.00002769809,0.002726592,0.9902776,0.00004135033,0.003526432,0.00001808419],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9398823,0.005356018,0.04128556,0.0002791887,0.00009441773,0.001269843,0.003257651,0.0007844263,0.007790448],"genre_scores_gemma":[0.932873,0.005945757,0.04284151,0.0002565485,0.00003960205,0.0007645527,0.004714562,0.0001316542,0.01243284],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.002534639,"threshold_uncertainty_score":0.008479178,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.01794543454844468,"score_gpt":0.2477495730874491,"score_spread":0.2298041385390044,"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."}}