{"id":"W4243484007","doi":"10.1063/1.4914923.2","title":"10.1063/1.4914923.2","year":2015,"lang":"en","type":"dataset","venue":"Default Digital Object Group","topic":"Mass Spectrometry Techniques and Applications","field":"Chemistry","cited_by":0,"is_retracted":false,"has_abstract":true,"ca_institutions":"Western University","funders":"","keywords":"Chemistry; Aqueous solution; PEG ratio; Solvent; Macromolecule; Ethylene glycol; Solvation; Chemical physics; Chemical engineering; Molecular dynamics; Ion; Surface charge; Computational chemistry; Organic chemistry; Physical chemistry","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":["insufficient_payload"],"consensus_categories":["insufficient_payload"],"category_scores_codex":[0.0004397819,0.001211926,0.001546722,0.001711058,0.001390183,0.00303076,0.003341687,0.00386873,0.787412],"category_scores_gemma":[0.0006854783,0.0005293172,0.0009238261,0.002939332,0.001132458,0.001941961,0.003095041,0.002621795,0.7296574],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.001759628,"about_ca_system_score_gemma":0.000599579,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.001755165,"about_ca_topic_score_gemma":0.00179161,"domain_scores_codex":[0.9995304,0.00006490757,0.00001902192,0.00009201765,0.0002071073,0.00008651665],"domain_scores_gemma":[0.9997711,0.00004225205,0.0000153838,0.00007122643,0.00004367767,0.00005641787],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"not_applicable","study_design_gemma":"not_applicable","study_design_scores_codex":[0.000384489,0.0005393629,0.00208475,0.001364656,0.0001625821,0.0008069415,0.0002194041,0.006544719,0.02226541,0.04933787,0.5792298,0.33706],"study_design_scores_gemma":[0.00009542707,0.00004057856,0.0006804131,0.000193134,0.00002067204,0.0003838163,0.00005691704,0.01700566,0.002884509,0.009815503,0.968769,0.00005445397],"study_design_candidate":"not_applicable","study_design_consensus":"not_applicable","genre_codex":"other","genre_gemma":"dataset","genre_scores_codex":[0.006148507,0.004533883,0.02454262,0.002591789,0.002661546,0.0004705517,0.01355763,0.01441521,0.9310783],"genre_scores_gemma":[0.08442608,0.004889071,0.0296773,0.002866212,0.0007458452,0.001928272,0.04441134,0.005953787,0.825102],"genre_candidate":"dataset","genre_consensus":null,"teacher_disagreement_score":0.212588,"threshold_uncertainty_score":0.3032309,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.01406231652674475,"score_gpt":0.2650089007010978,"score_spread":0.250946584174353,"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."}}