Site of reactivity models predict molecular reactivity of diverse chemicals with glutathione.
about
Deep learning for computational chemistry.Modeling Reactivity to Biological Macromolecules with a Deep Multitask Network.Energy of the Lowest Unoccupied Molecular Orbital, Thiol Reactivity, and Toxicity of Three Monobrominated Water Disinfection Byproducts.Modeling Epoxidation of Drug-like Molecules with a Deep Machine Learning Network.Synthesis of Novel Pyrido[4,3-e][1,2,4]triazino[3,2-c][1,2,4]thiadiazine 6,6-dioxide Derivatives with Potential Anticancer Activity.Tracking Where the O's Go.Deep Learning to Predict the Formation of Quinone Species in Drug Metabolism.In vitro metabolism study of a novel P38 kinase inhibitor: in silico predictions, structure elucidation using MS/MS-I.Computational Approach to Structural Alerts: Furans, Phenols, Nitroaromatics, and Thiophenes.Computationally Assessing the Bioactivation of Drugs by N-Dealkylation.Learning a Local-Variable Model of Aromatic and Conjugated Systems.Understanding P450-mediated Bio-transformations into Epoxide and Phenolic Metabolites.
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Q30399624-B122B244-A26D-4D2C-AF21-30521C3CDB01Q37209287-216794CF-8770-45D9-819F-1B056504E5E7Q39223898-33C8E41A-9804-4FCA-8324-EE186B50B5DDQ40028855-A27A892D-92B3-459D-A803-052EFCD77D4DQ40147418-A414CD18-F046-4179-BC18-0D8C0BDBECCBQ42907686-8DC68365-301E-4A10-BA89-6CED2D6E2F06Q46431115-3B7EA475-1440-4251-BBDF-7E15D950962EQ47295040-3383A57D-BDB2-45A4-85F4-73A24E34750AQ47951975-AE4796A1-9BCD-446B-966F-331DF053E773Q48199323-91ACBDFE-5DCE-4CE4-ABAC-9FD97E0C3EAEQ49384986-62989DFA-FCBD-4C4B-9E8D-9BBDC0343182Q53667728-BA7F9247-7765-40C0-BB76-06C2824B2DD7
P2860
Site of reactivity models predict molecular reactivity of diverse chemicals with glutathione.
description
2015 nî lūn-bûn
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2015年の論文
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2015年学术文章
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2015年学术文章
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2015年学术文章
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2015年学术文章
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name
Site of reactivity models pred ...... se chemicals with glutathione.
@en
type
label
Site of reactivity models pred ...... se chemicals with glutathione.
@en
prefLabel
Site of reactivity models pred ...... se chemicals with glutathione.
@en
P2860
P1476
Site of reactivity models pred ...... rse chemicals with glutathione
@en
P2093
Tyler B Hughes
P2860
P304
P356
10.1021/ACS.CHEMRESTOX.5B00017
P577
2015-03-16T00:00:00Z