{"id":"W4253686242","doi":"10.1063/1.4914923.1","title":"10.1063/1.4914923.1","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":"Aqueous solution; Chemistry; Solvent; PEG ratio; Macromolecule; Chemical physics; Solvation; Ethylene glycol; Chemical engineering; Ion; Molecular dynamics; 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":[0.0004465937,0.001140552,0.001468137,0.0015392,0.001219016,0.002648748,0.00300455,0.003591641,0.7163],"category_scores_gemma":[0.0007687144,0.0004640889,0.0007553513,0.002908344,0.0009867032,0.002007106,0.002827138,0.00248003,0.6358042],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.001741101,"about_ca_system_score_gemma":0.0005895402,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.001671107,"about_ca_topic_score_gemma":0.001870996,"domain_scores_codex":[0.9995153,0.00007394166,0.00001892561,0.0000910819,0.0002191862,0.00008155704],"domain_scores_gemma":[0.99975,0.00005056247,0.00001751986,0.00007490015,0.00004944412,0.00005765578],"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":[0.0004282761,0.0005131839,0.002218421,0.00147697,0.0001583649,0.0007551319,0.0002397353,0.009210213,0.02455335,0.05746826,0.5474725,0.3555056],"study_design_scores_gemma":[0.00009471922,0.00005082513,0.0008328586,0.0002194472,0.0000239866,0.0003773048,0.00006196585,0.02824097,0.003323441,0.0140315,0.9526787,0.00006415237],"study_design_candidate":"not_applicable","study_design_consensus":"not_applicable","genre_codex":"other","genre_gemma":"dataset","genre_scores_codex":[0.008863345,0.0058753,0.03102853,0.002793353,0.00316687,0.0004641246,0.01439685,0.01515953,0.9182522],"genre_scores_gemma":[0.1139444,0.006590362,0.03554435,0.002734433,0.0008386183,0.001910489,0.05457651,0.006845051,0.7770157],"genre_candidate":"dataset","genre_consensus":null,"teacher_disagreement_score":0.2837,"threshold_uncertainty_score":0.4046637,"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."}}