{"id":"W3176629778","doi":"10.1039/d1cp02045e","title":"The formulation of chemical potentials and free energy changes in biochemical reactions","year":2021,"lang":"en","type":"article","venue":"Physical Chemistry Chemical Physics","topic":"thermodynamics and calorimetric analyses","field":"Chemistry","cited_by":2,"is_retracted":false,"has_abstract":true,"ca_institutions":"Stillwater (Canada)","funders":"Biological and Environmental Research; National Institute of Biomedical Imaging and Bioengineering; U.S. Department of Energy","keywords":"Chemical nomenclature; Chemical reaction; Chemistry; Computational chemistry; Energy (signal processing); Gibbs free energy; Thermodynamics; Organic chemistry; Physics; Mathematics; Statistics","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":[0.004210433,0.00204979,0.001173865,0.002171474,0.00107186,0.002622396,0.003090938,0.002529182,0.00474068],"category_scores_gemma":[0.007554742,0.0007599244,0.001959599,0.001471445,0.005102032,0.006934631,0.002825481,0.00484903,0.001941401],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.001954281,"about_ca_system_score_gemma":0.001330813,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.001201767,"about_ca_topic_score_gemma":0.0005937393,"domain_scores_codex":[0.9975389,0.0009579971,0.0001583311,0.0004279899,0.0007631615,0.0001535889],"domain_scores_gemma":[0.9978382,0.001262866,0.0002406532,0.0002400327,0.0003490434,0.00006932008],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"theoretical_or_conceptual","study_design_gemma":"theoretical_or_conceptual","study_design_scores_codex":[0.00001809231,0.00002279952,0.00009702173,0.0001525032,0.00001327984,0.00008487132,0.0001176631,0.02719947,0.003365058,0.9581215,0.0008578766,0.009949869],"study_design_scores_gemma":[0.00001184391,0.00007653923,0.0002064099,0.00006896257,0.00001724656,0.0002158731,0.00007348894,0.1764022,0.004049907,0.7983163,0.02050485,0.00005643256],"study_design_candidate":"theoretical_or_conceptual","study_design_consensus":"theoretical_or_conceptual","genre_codex":"methods","genre_gemma":"empirical","genre_scores_codex":[0.01334608,0.004872969,0.9458632,0.001963469,0.001320628,0.0001631016,0.0002871617,0.0001721268,0.03201117],"genre_scores_gemma":[0.4861812,0.01239646,0.4477025,0.001794455,0.002239497,0.00149589,0.0008844337,0.001548657,0.0457569],"genre_candidate":"empirical","genre_consensus":null,"teacher_disagreement_score":0.00474068,"threshold_uncertainty_score":0.02226716,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.01063984026101505,"score_gpt":0.2342033860181903,"score_spread":0.2235635457571752,"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."}}