{"id":"W2055419391","doi":"10.1016/s0006-3495(01)75889-4","title":"Peter A. Kollman, 1945–2001","year":2001,"lang":"de","type":"article","venue":"Biophysical Journal","topic":"Protein Structure and Dynamics","field":"Biochemistry, Genetics and Molecular Biology","cited_by":1,"is_retracted":false,"has_abstract":false,"ca_institutions":"Merck Canada Inc. (Canada)","funders":"","keywords":"Chemist; Library science; History; Classics; Chemistry; Art history; Operations research; Sociology; Engineering; Computer science","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":[0.001499516,0.001103442,0.000940467,0.001483326,0.0006747047,0.001273283,0.000781455,0.001593601,0.05415586],"category_scores_gemma":[0.001773557,0.0004067603,0.0003302865,0.0008064789,0.0009473509,0.002012674,0.001335245,0.002915148,0.05712923],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0009981242,"about_ca_system_score_gemma":0.0007777005,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0007427566,"about_ca_topic_score_gemma":0.001029222,"domain_scores_codex":[0.9996313,0.00004129295,0.00002958756,0.000136163,0.0001317744,0.00002991475],"domain_scores_gemma":[0.9991067,0.0001939632,0.00007944815,0.00005106753,0.0003194157,0.0002493453],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"design_other","study_design_gemma":"not_applicable","study_design_scores_codex":[0.0004068183,0.00006541263,0.0004306438,0.0008377993,0.00004926876,0.0003977431,0.0002009817,0.0005595454,0.009266345,0.02120752,0.453338,0.5132399],"study_design_scores_gemma":[0.00001249085,0.00005121708,0.0005129375,0.0001366039,0.00001679852,0.0004735056,0.0000266653,0.0001926663,0.002811343,0.002786867,0.9929593,0.0000197715],"study_design_candidate":"not_applicable","study_design_consensus":null,"genre_codex":"review","genre_gemma":"other","genre_scores_codex":[0.004657392,0.6682563,0.03320863,0.07244881,0.08727621,0.0001469923,0.001572677,0.0008099217,0.131623],"genre_scores_gemma":[0.02834904,0.3474539,0.009419439,0.005830572,0.01690524,0.0001209994,0.0007833145,0.000453951,0.5906835],"genre_candidate":"other","genre_consensus":null,"teacher_disagreement_score":0.05415586,"threshold_uncertainty_score":0.1811694,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.008196282878662415,"score_gpt":0.2438646729675104,"score_spread":0.2356683900888479,"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."}}