{"id":"W6931011579","doi":"10.5281/zenodo.15313341","title":"ACEsuit/mace: v0.3.13","year":2025,"lang":"en","type":"other","venue":"Zenodo (CERN European Organization for Nuclear Research)","topic":"Copper-based nanomaterials and applications","field":"Materials Science","cited_by":0,"is_retracted":false,"has_abstract":true,"ca_institutions":"University of British Columbia","funders":"","keywords":"Python (programming language); Computation; Property (philosophy); Profiling (computer programming); Transferability; Molecular dynamics; Flexibility (engineering)","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":[],"category_scores_codex":[0.002582828,0.003610382,0.002226274,0.002043688,0.001228296,0.004647582,0.009491521,0.002248294,0.4039427],"category_scores_gemma":[0.008226394,0.003087061,0.003895477,0.001596151,0.0008920438,0.005151839,0.004529859,0.004626735,0.3596279],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.001591989,"about_ca_system_score_gemma":0.002397621,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.005963262,"about_ca_topic_score_gemma":0.005688633,"domain_scores_codex":[0.9986587,0.0001680012,0.0001176584,0.0002283172,0.0005870813,0.0002403245],"domain_scores_gemma":[0.9978234,0.000395677,0.000115117,0.0006024431,0.0008806015,0.0001828433],"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":[0.0001698151,0.00004336532,0.000469394,0.0006695138,0.0000991605,0.0001027666,0.00008292443,0.001734557,0.001157697,0.005218701,0.9733853,0.0168668],"study_design_scores_gemma":[0.0002601192,0.00004879954,0.0008588081,0.0003215718,0.00006054511,0.0002453593,0.00005082292,0.01493177,0.01192363,0.01206972,0.959075,0.0001538334],"study_design_candidate":"not_applicable","study_design_consensus":"not_applicable","genre_codex":"software","genre_gemma":"software","genre_scores_codex":[0.0012892,0.0005385694,0.08111933,0.0005283142,0.0005662635,0.000225324,0.09394272,0.7849801,0.03681015],"genre_scores_gemma":[0.01189537,0.000671487,0.06028331,0.001119836,0.0001690299,0.001064347,0.1743469,0.7066699,0.04377993],"genre_candidate":"software","genre_consensus":"software","teacher_disagreement_score":0.4039427,"threshold_uncertainty_score":0.8502034,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.0232233500316732,"score_gpt":0.2561513204545591,"score_spread":0.2329279704228859,"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."}}