{"id":"W7162009428","doi":"10.82308/18556","title":"Design, synthesis, and biological evaluation of selective estrogen receptor modulator/histone deacetylase inhibitor hybrid molecules","year":2017,"lang":"en","type":"dissertation","venue":"","topic":"Estrogen and related hormone effects","field":"Biochemistry, Genetics and Molecular Biology","cited_by":0,"is_retracted":false,"has_abstract":true,"ca_institutions":"","funders":"","keywords":"Pharmacophore; Tamoxifen; Raloxifene; Selective estrogen receptor modulator; In silico; Estrogen receptor; Virtual screening; Small molecule","routes":{"ca_aff":false,"ca_fund":false,"ca_venue":false,"about_ca":true,"invisible_to_affiliation_only":true},"retraction":null,"screen":null,"direct_labels":[],"prediction":{"model_version":"metacan-v3-hybrid-931329e0061c","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0002256735,0.0003749255,0.0003445895,0.0003345241,0.0001355388,0.0002814506,0.0003539672,0.0003056,0.001957699],"category_scores_gemma":[0.0001328372,0.0001731663,0.0003757972,0.0002943178,0.000105757,0.0002852619,0.0002423412,0.0003826753,0.000490569],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0002874339,"about_ca_system_score_gemma":0.0001529457,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0002561405,"about_ca_topic_score_gemma":0.0006539324,"domain_scores_codex":[0.9999125,0.00001313274,0.000007547219,0.00001977442,0.00002423612,0.00002288738],"domain_scores_gemma":[0.9999636,0.000004613358,0.000008657541,0.000002921832,0.000009255142,0.00001087246],"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":[0.000507993,0.0005187835,0.0003215592,0.0008259132,0.00012849,0.0002838435,0.00008768442,0.0057115,0.9487985,0.002050848,0.0008426809,0.03992214],"study_design_scores_gemma":[0.0003863897,0.01026491,0.002178921,0.0000816215,0.0002237926,0.0004796206,0.0001027023,0.006484314,0.9387611,0.0004047421,0.04056996,0.00006191342],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.942512,0.01315392,0.02576375,0.0003974861,0.0001747561,0.0008636467,0.002053022,0.0003316452,0.01474971],"genre_scores_gemma":[0.9614739,0.008828358,0.02103703,0.0002594098,0.00002675422,0.0004216757,0.00145878,0.00003076978,0.00646338],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.001957699,"threshold_uncertainty_score":0.00654912,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.01899265995605641,"score_gpt":0.2983142151996767,"score_spread":0.2793215552436202,"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."}}