These tools will no longer be maintained as of December 31, 2024. Archived website can be found here. PubMed4Hh GitHub repository can be found here. Contact NLM Customer Service if you have questions.


BIOMARKERS

Molecular Biopsy of Human Tumors

- a resource for Precision Medicine *

351 related articles for article (PubMed ID: 26841076)

  • 21. Multi-structural variational kinetics study on hydrogen abstraction reactions of cyclopentanol and cyclopentane by hydroperoxyl radical with anharmonicity, recrossing and tunneling effects.
    Yang M; Wang J
    Phys Chem Chem Phys; 2023 May; 25(18):12943-12960. PubMed ID: 37098872
    [TBL] [Abstract][Full Text] [Related]  

  • 22. Comprehensive Multipath Variational Kinetics Study on Hydrogen Abstraction Reactions from Three Typical Dimethylcyclohexane Isomers by Hydroxyl Radicals: from the Electronic Structure to Model Applications.
    Yang M; Wang J
    J Phys Chem A; 2024 Jun; 128(22):4517-4531. PubMed ID: 38804972
    [TBL] [Abstract][Full Text] [Related]  

  • 23. Path-dependent variational effects and multidimensional tunneling in multi-path variational transition state theory: rate constants calculated for the reactions of HO2 with tert-butanol by including all 46 paths for abstraction at C and all six paths for abstraction at O.
    Bao JL; Sripa P; Truhlar DG
    Phys Chem Chem Phys; 2016 Jan; 18(2):1032-41. PubMed ID: 26658549
    [TBL] [Abstract][Full Text] [Related]  

  • 24. A kinetics study on hydrogen abstraction reactions of cyclopentane by hydrogen, methyl, and ethyl radicals.
    Chen W; Guo X; Chen L; Zhang R; Li Y; Feng H; Xu X; Zhang X
    Phys Chem Chem Phys; 2021 Mar; 23(12):7333-7342. PubMed ID: 33876093
    [TBL] [Abstract][Full Text] [Related]  

  • 25. Ab Initio, Transition State Theory, and Kinetic Modeling Study of the HO
    Monge-Palacios M; Grajales-González E; Sarathy SM
    J Phys Chem A; 2018 Dec; 122(51):9792-9805. PubMed ID: 30500199
    [TBL] [Abstract][Full Text] [Related]  

  • 26. Relative Rates of Hydrogen Shift Isomerizations Depend Strongly on Multiple-Structure Anharmonicity.
    Xing L; Bao JL; Wang Z; Wang X; Truhlar DG
    J Am Chem Soc; 2018 Dec; 140(50):17556-17570. PubMed ID: 30468384
    [TBL] [Abstract][Full Text] [Related]  

  • 27. High-level direct-dynamics variational transition state theory calculations including multidimensional tunneling of the thermal rate constants, branching ratios, and kinetic isotope effects of the hydrogen abstraction reactions from methanol by atomic hydrogen.
    Meana-Pañeda R; Truhlar DG; Fernández-Ramos A
    J Chem Phys; 2011 Mar; 134(9):094302. PubMed ID: 21384964
    [TBL] [Abstract][Full Text] [Related]  

  • 28. Dual-level strategy for quantitative kinetics for the reaction between ethylene and hydroxyl radical.
    Li J; Long B
    J Chem Phys; 2024 May; 160(17):. PubMed ID: 38748004
    [TBL] [Abstract][Full Text] [Related]  

  • 29. Multistructural Anharmonicity Controls the Radical Generation Process in Biofuel Combustion.
    Xing L; Wang Z; Truhlar DG
    J Am Chem Soc; 2019 Nov; 141(46):18531-18543. PubMed ID: 31637914
    [TBL] [Abstract][Full Text] [Related]  

  • 30. Multistructural Variational Reaction Kinetics of the Simplest Unsaturated Methyl Ester: H-Abstraction from Methyl Acrylate by H, OH, CH
    Li W; Li J; Ning H; Shang Y; Luo SN
    J Phys Chem A; 2021 Jun; 125(23):5103-5116. PubMed ID: 34082530
    [TBL] [Abstract][Full Text] [Related]  

  • 31. Multipath variational transition state theory: rate constant of the 1,4-hydrogen shift isomerization of the 2-cyclohexylethyl radical.
    Yu T; Zheng J; Truhlar DG
    J Phys Chem A; 2012 Jan; 116(1):297-308. PubMed ID: 22126663
    [TBL] [Abstract][Full Text] [Related]  

  • 32. Direct dynamics study on the reaction of acetaldehyde with ozone.
    Yang J; Li QS; Zhang S
    J Comput Chem; 2008 Jan; 29(2):247-55. PubMed ID: 17559074
    [TBL] [Abstract][Full Text] [Related]  

  • 33. Explanation of the unusual temperature dependence of the atmospherically important OH + H(2)S --> H(2)O + HS reaction and prediction of the rate constant at combustion temperatures.
    Ellingson BA; Truhlar DG
    J Am Chem Soc; 2007 Oct; 129(42):12765-71. PubMed ID: 17910447
    [TBL] [Abstract][Full Text] [Related]  

  • 34. Importance of anharmonicity, recrossing effects, and quantum mechanical tunneling in transition state theory with semiclassical tunneling. A test case: the H2 + Cl hydrogen abstraction reaction.
    Sansón JA; Sánchez ML; Corchado JC
    J Phys Chem A; 2006 Jan; 110(2):589-99. PubMed ID: 16405331
    [TBL] [Abstract][Full Text] [Related]  

  • 35. Quantum chemical study of the thermal decomposition of o-quinone methide (6-methylene-2,4-cyclohexadien-1-one).
    Silva Gd; Bozzelli JW
    J Phys Chem A; 2007 Aug; 111(32):7987-94. PubMed ID: 17645323
    [TBL] [Abstract][Full Text] [Related]  

  • 36. Pressure-dependent kinetics of methyl formate reactions with OH at combustion, atmospheric and interstellar temperatures.
    Wu J; Ning H; Ma L; Ren W
    Phys Chem Chem Phys; 2018 Nov; 20(41):26190-26199. PubMed ID: 30311927
    [TBL] [Abstract][Full Text] [Related]  

  • 37. Multi-path variational transition state theory for chiral molecules: the site-dependent kinetics for abstraction of hydrogen from 2-butanol by hydroperoxyl radical, analysis of hydrogen bonding in the transition state, and dramatic temperature dependence of the activation energy.
    Bao JL; Meana-Pañeda R; Truhlar DG
    Chem Sci; 2015 Oct; 6(10):5866-5881. PubMed ID: 29861912
    [TBL] [Abstract][Full Text] [Related]  

  • 38. Prediction of experimentally unavailable product branching ratios for biofuel combustion: the role of anharmonicity in the reaction of isobutanol with OH.
    Zheng J; Meana-Pañeda R; Truhlar DG
    J Am Chem Soc; 2014 Apr; 136(13):5150-60. PubMed ID: 24650093
    [TBL] [Abstract][Full Text] [Related]  

  • 39. Ab Initio Chemical Kinetics for the CH3 + O((3)P) Reaction and Related Isomerization-Decomposition of CH3O and CH2OH Radicals.
    Xu ZF; Raghunath P; Lin MC
    J Phys Chem A; 2015 Jul; 119(28):7404-17. PubMed ID: 25751420
    [TBL] [Abstract][Full Text] [Related]  

  • 40. Computational Kinetics by Variational Transition-State Theory with Semiclassical Multidimensional Tunneling: Direct Dynamics Rate Constants for the Abstraction of H from CH
    Meana-Pañeda R; Xu X; Ma H; Truhlar DG
    J Phys Chem A; 2017 Mar; 121(8):1693-1707. PubMed ID: 28140597
    [TBL] [Abstract][Full Text] [Related]  

    [Previous]   [Next]    [New Search]
    of 18.