{"id":"W2138253668","doi":"10.1002/anie.201100910","title":"Soluble Synthetic Analogues of Malaria Pigment: Structure of Mesohematin Anhydride and its Interaction with Chloroquine in Solution","year":2011,"lang":"en","type":"article","venue":"Angewandte Chemie International Edition","topic":"Malaria Research and Control","field":"Medicine","cited_by":21,"is_retracted":false,"has_abstract":true,"ca_institutions":"McGill University","funders":"","keywords":"Porphyrin; Drug; Chemistry; Chloroquine; Combinatorial chemistry; Solubility; Malaria; Stereochemistry; Organic chemistry; Pharmacology; Medicine","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":[0.0000670173,0.0001323942,0.00009532988,0.00005508097,0.00008389317,0.0000909505,0.0002103128,0.0001696083,0.001217035],"category_scores_gemma":[0.00008026882,0.00006251829,0.0000713572,0.00009587934,0.0001375182,0.0001398487,0.00007649318,0.0002911868,0.0002005784],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0001807713,"about_ca_system_score_gemma":0.0001101922,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0006283165,"about_ca_topic_score_gemma":0.0005491726,"domain_scores_codex":[0.9999563,0.000009694287,0.00000205073,0.00001012504,0.00001210025,0.00000978468],"domain_scores_gemma":[0.9999629,0.000008967981,0.00001056253,0.000004170148,0.000003843084,0.000009511923],"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":[0.0002060159,0.00003272183,0.00007166517,0.00007414597,0.000006807363,0.000071976,0.00002284224,0.0004163783,0.9973038,0.0003929662,0.0001177441,0.001282978],"study_design_scores_gemma":[0.00006253893,0.0005921257,0.00131769,0.00000605361,0.00001089801,0.000153391,0.00002845742,0.001488443,0.9921827,0.0001128788,0.0040389,0.000005969872],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9926108,0.001708386,0.002046037,0.0001187782,0.00002458941,0.00002862412,0.0002176555,0.00003036862,0.003214801],"genre_scores_gemma":[0.9953794,0.0008468594,0.001488498,0.00003619328,0.000007858745,0.00001266362,0.0003260932,0.000009974921,0.001892374],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.001217035,"threshold_uncertainty_score":0.004071414,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.0215475036200732,"score_gpt":0.2638406075788368,"score_spread":0.2422931039587636,"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."}}