{"id":"W4206705069","doi":"10.1002/chem.202104481","title":"Structure‐ and Interaction‐Based Design of Anti‐SARS‐CoV‐2 Aptamers","year":2022,"lang":"en","type":"article","venue":"Chemistry - A European Journal","topic":"Advanced biosensing and bioanalysis techniques","field":"Biochemistry, Genetics and Molecular Biology","cited_by":28,"is_retracted":false,"has_abstract":true,"ca_institutions":"University of Ottawa","funders":"H2020 Marie Skłodowska-Curie Actions; Russian Academy of Sciences; Russian Foundation for Basic Research; Horizon 2020 Framework Programme; Grand Équipement National De Calcul Intensif; Canadian Institutes of Health Research; China Scholarship Council; Russian Science Foundation; Ministry of Education and Science of the Russian Federation; Office of Science; Partnership for Advanced Computing in Europe AISBL; Argonne National Laboratory; European Commission; U.S. Department of Energy","keywords":"Severe acute respiratory syndrome coronavirus 2 (SARS-CoV-2); Coronavirus disease 2019 (COVID-19); Aptamer; 2019-20 coronavirus outbreak; Computational biology; Sars virus; Virology; Computer science; Biology; Medicine; Genetics; Infectious disease (medical specialty)","routes":{"ca_aff":true,"ca_fund":true,"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":[0.0003105326,0.0004741557,0.0005604383,0.0002706339,0.0001395513,0.0003948335,0.0004384029,0.0004660515,0.0008941398],"category_scores_gemma":[0.0002488192,0.0003576206,0.0004986721,0.000155958,0.000211228,0.0002209291,0.0002583668,0.000378441,0.0004692437],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0005008326,"about_ca_system_score_gemma":0.0005400569,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0003068828,"about_ca_topic_score_gemma":0.0003526944,"domain_scores_codex":[0.999792,0.00004603788,0.00001405959,0.00004401696,0.00007345727,0.00003045688],"domain_scores_gemma":[0.999933,0.00001454399,0.00001528926,0.000006537722,0.00001741925,0.00001319933],"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":[0.0001733732,0.0001539299,0.000388623,0.0001567577,0.00003358971,0.0001240134,0.0000371476,0.1235665,0.8504615,0.002403618,0.0002134531,0.02228749],"study_design_scores_gemma":[0.0001407661,0.001167944,0.0007525854,0.00001221135,0.0000559975,0.0002385025,0.00002545524,0.3755583,0.612242,0.001247199,0.008526613,0.00003237371],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.5051554,0.001754534,0.485039,0.0001874137,0.0000710661,0.000481172,0.0002554544,0.0007515351,0.00630455],"genre_scores_gemma":[0.7667825,0.001038792,0.2285409,0.0001511109,0.00001525816,0.0003526129,0.0004338268,0.0000808244,0.002604072],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.0008941398,"threshold_uncertainty_score":0.003633797,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.0173390168404133,"score_gpt":0.2641987730584682,"score_spread":0.2468597562180549,"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."}}