{"id":"W2918182323","doi":"10.1002/cptc.201900016","title":"Photoswitchable Affinity Reagents: Computational Design and Efficient Red‐Light Switching","year":2019,"lang":"en","type":"article","venue":"ChemPhotoChem","topic":"Photochromic and Fluorescence Chemistry","field":"Materials Science","cited_by":18,"is_retracted":false,"has_abstract":true,"ca_institutions":"University of Saskatchewan; University of Toronto","funders":"National Institute of General Medical Sciences","keywords":"Azobenzene; Reagent; Chemistry; Function (biology); Combinatorial chemistry; Linker; Modular design; Materials science; Computer science; Molecule; Organic chemistry; Biology","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":[0.0005805389,0.0005418995,0.000796166,0.0003857715,0.0003326008,0.0006391939,0.001007776,0.0007585511,0.002068298],"category_scores_gemma":[0.0007215504,0.0004290818,0.0004225991,0.0002621118,0.0003002578,0.0003911037,0.0003280306,0.0006437175,0.0001820561],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0008156057,"about_ca_system_score_gemma":0.001583286,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.003619937,"about_ca_topic_score_gemma":0.007590416,"domain_scores_codex":[0.9999213,0.00002551198,0.00000318751,0.0000130212,0.00001556371,0.0000212517],"domain_scores_gemma":[0.9997683,0.0001595714,0.00001491887,0.00001124354,0.00003142372,0.00001456773],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"simulation_or_modeling","study_design_gemma":"simulation_or_modeling","study_design_scores_codex":[0.0002337272,0.0001969803,0.001958347,0.0002317658,0.000068356,0.0002033196,0.00005205539,0.9635442,0.008005208,0.01193321,0.0006276615,0.01294527],"study_design_scores_gemma":[0.00008719545,0.00007575138,0.0001095373,0.000006256514,0.00001599973,0.000009843608,0.00002890737,0.9955642,0.00249842,0.001051424,0.0005470542,0.000005325006],"study_design_candidate":"simulation_or_modeling","study_design_consensus":"simulation_or_modeling","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.930071,0.000425663,0.05943709,0.0003926743,0.00003971804,0.0001604565,0.0004048392,0.0003535036,0.008715046],"genre_scores_gemma":[0.9188338,0.0002871094,0.07841461,0.0001152285,0.000008110204,0.0003936155,0.0004054848,0.00005326617,0.001488803],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.003619937,"threshold_uncertainty_score":0.007197738,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.01074842120337656,"score_gpt":0.2196416077656202,"score_spread":0.2088931865622436,"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."}}