{"id":"W4296017074","doi":"10.3390/molecules27185923","title":"Synthesis of Potential Antiviral Agents for SARS-CoV-2 Using Molecular Hybridization Approach","year":2022,"lang":"en","type":"article","venue":"Molecules","topic":"Synthesis and biological activity","field":"Chemistry","cited_by":19,"is_retracted":false,"has_abstract":true,"ca_institutions":"Western University","funders":"King Abdulaziz University","keywords":"Cytotoxicity; Conjugate; Chemistry; Combinatorial chemistry; Molecule; Virology; Stereochemistry; Biology; Biochemistry; Organic chemistry; In vitro","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":"codex-gemma-dda1882f352a","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0001347429,0.0001235979,0.0002147536,0.00003685983,0.0001417061,0.00001544868,0.0001920862,0.00005197733,0.00005025516],"category_scores_gemma":[0.0001208652,0.0001136966,0.0001812767,0.00009002852,0.00004730798,0.00003283456,0.0001427073,0.00006908943,5.253159e-7],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.00004208556,"about_ca_system_score_gemma":0.00001885057,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.00003026005,"about_ca_topic_score_gemma":2.085397e-7,"domain_scores_codex":[0.999081,0.00006519341,0.0001877486,0.0002765982,0.0002058329,0.0001836388],"domain_scores_gemma":[0.9995847,0.000051242,0.0001443319,0.0001716909,0.00003313768,0.00001490052],"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":[0.00006377988,0.0002853164,0.0001936332,0.00006513737,0.00004882411,0.000006839758,0.000009506276,0.0006422519,0.9908291,0.0001896718,0.00005333529,0.007612651],"study_design_scores_gemma":[0.0001399591,0.000020652,0.00008863417,0.00000725349,0.0000559193,0.000006687268,0.00005801733,0.03410077,0.9648005,0.0002524187,0.0003324223,0.0001367115],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.944312,0.00004658694,0.05323714,0.00002381206,0.00003118475,0.00009512805,0.0001555073,0.00002877154,0.002069882],"genre_scores_gemma":[0.9947681,0.000002299043,0.005004886,0.00004976496,0.00002973448,0.00006296264,0.00004585079,0.00001895214,0.00001745297],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.05045611,"threshold_uncertainty_score":0.4636413,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.04037250869879772,"score_gpt":0.2669286288078218,"score_spread":0.226556120109024,"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."}}