{"id":"W1576063160","doi":"10.1002/9783527611546.ch29","title":"Multiple Proton Transfer: From Stepwise to Concerted","year":2006,"lang":"en","type":"other","venue":"","topic":"Chemical Reactions and Mechanisms","field":"Chemistry","cited_by":6,"is_retracted":false,"has_abstract":true,"ca_institutions":"Steacie Institute for Molecular Sciences","funders":"","keywords":"Proton; Intramolecular force; Formic acid; Quantum tunnelling; Transfer (computing); Chemical physics; Chemistry; Computational chemistry; Physics; Stereochemistry; Nuclear physics; Computer science; Quantum mechanics; Organic 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":[],"consensus_categories":[],"category_scores_codex":[0.0003024675,0.0006577304,0.0004550384,0.0002382083,0.0004680235,0.0008869544,0.001055079,0.000432614,0.01356464],"category_scores_gemma":[0.0004766958,0.0004166883,0.0004372354,0.0002259114,0.0005520015,0.002595762,0.0008592948,0.0009019528,0.002174067],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0004703803,"about_ca_system_score_gemma":0.0003148048,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0001878934,"about_ca_topic_score_gemma":0.0002451284,"domain_scores_codex":[0.9998537,0.00001576332,0.000007099451,0.00005898635,0.00003981837,0.00002457194],"domain_scores_gemma":[0.9998791,0.00004223273,0.00001424919,0.00003558713,0.00001550086,0.00001324035],"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":[0.000435331,0.0002916347,0.001034266,0.001027741,0.00008572879,0.000804759,0.0005671823,0.01926672,0.3983567,0.4281087,0.005841138,0.1441801],"study_design_scores_gemma":[0.0001100799,0.0008526192,0.001276169,0.0001132149,0.0001241854,0.001434268,0.0003817005,0.1561358,0.6125175,0.1716444,0.05525792,0.0001521548],"study_design_candidate":"theoretical_or_conceptual","study_design_consensus":"theoretical_or_conceptual","genre_codex":"methods","genre_gemma":"other","genre_scores_codex":[0.3419533,0.008172224,0.5153018,0.001652865,0.001303653,0.0003365689,0.0005522605,0.002507402,0.1282199],"genre_scores_gemma":[0.9176362,0.004525315,0.04458595,0.0001907863,0.0001357986,0.0001766435,0.0002456593,0.0002398656,0.03226381],"genre_candidate":"other","genre_consensus":null,"teacher_disagreement_score":0.01356464,"threshold_uncertainty_score":0.04537827,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.01121330810921552,"score_gpt":0.2268521838936983,"score_spread":0.2156388757844827,"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."}}