{"id":"W2051835701","doi":"10.1021/om0205142","title":"Experimental and Computational Study of Pincer Complexes of Ruthenium with Py, CO, and N<sub>2</sub> Ligands","year":2002,"lang":"en","type":"article","venue":"Organometallics","topic":"Organometallic Complex Synthesis and Catalysis","field":"Chemistry","cited_by":42,"is_retracted":false,"has_abstract":true,"ca_institutions":"Wilfrid Laurier University","funders":"","keywords":"Chemistry; Pincer movement; Hydride; Decarbonylation; Pyridine; Intramolecular force; Ruthenium; Medicinal chemistry; Stereochemistry; ONIOM; Olefin fiber; Molecule; Organic chemistry; Catalysis","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":["insufficient_payload"],"consensus_categories":[],"category_scores_codex":[0.00007794429,0.0002306376,0.0005266187,0.0001410166,0.00009636324,0.00003380633,0.0001619829,0.00005876992,0.002681906],"category_scores_gemma":[0.00001413333,0.0002017088,0.00005429646,0.0002879513,0.0002829795,0.00009524874,0.0001329017,0.00008306833,0.000002774788],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.00002106798,"about_ca_system_score_gemma":0.00001641853,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.00002144823,"about_ca_topic_score_gemma":0.000009581163,"domain_scores_codex":[0.9987406,0.00001619657,0.0004028936,0.0003438905,0.0003283056,0.0001681742],"domain_scores_gemma":[0.9991938,0.0001285332,0.0002218904,0.0002902759,0.00007932566,0.00008621547],"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":[0.00005699444,0.001791454,0.01106945,0.0001704624,0.0005362668,0.000003354241,0.002809602,0.00002662896,0.9798796,0.0003312282,0.0000210525,0.003303903],"study_design_scores_gemma":[0.001772791,0.000313488,0.01627939,0.00004430742,0.0002799618,0.00002031408,0.004754668,0.0007702578,0.9751514,0.00006018289,0.0002260414,0.0003272065],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9964106,0.0009973672,0.00006317953,0.00002882263,0.000008390954,0.0001120031,0.0000639342,0.00002475285,0.002290939],"genre_scores_gemma":[0.999448,0.0000492686,0.0001816017,0.00001263415,0.00001896954,0.00001085889,0.00002430782,0.00002614914,0.0002282267],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.005209939,"threshold_uncertainty_score":0.9982298,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.0163600181185185,"score_gpt":0.2218036336738234,"score_spread":0.2054436155553049,"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."}}