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 *

116 related articles for article (PubMed ID: 28101902)

  • 1. Global exploration of isomers and isomerization channels on the quantum chemical potential energy surface of H
    Ohno K; Kishimoto N; Iwamoto T; Satoh H
    J Comput Chem; 2017 Apr; 38(10):669-687. PubMed ID: 28101902
    [TBL] [Abstract][Full Text] [Related]  

  • 2. High performance global exploration of isomers and isomerization channels on quantum chemical potential energy surface of H
    Ohno K; Kishimoto N; Iwamoto T; Satoh H; Watanabe H
    J Comput Chem; 2021 Jan; 42(3):192-204. PubMed ID: 33146910
    [TBL] [Abstract][Full Text] [Related]  

  • 3. Global investigation on the potential energy surface of CH3CN: application of the scaled hypersphere search method.
    Yang X; Maeda S; Ohno K
    J Phys Chem A; 2005 Aug; 109(32):7319-28. PubMed ID: 16834097
    [TBL] [Abstract][Full Text] [Related]  

  • 4. Quantum chemical exploration of formaldehyde clusters (H
    Ohno K; Kodaya Y; Yamakado H
    J Comput Chem; 2018 Jul; 39(20):1498-1507. PubMed ID: 29607516
    [TBL] [Abstract][Full Text] [Related]  

  • 5. Exploration of Carbon Allotropes with Four-membered Ring Structures on Quantum Chemical Potential Energy Surfaces.
    Ohno K; Satoh H; Iwamoto T; Tokoyama H; Yamakado H
    J Comput Chem; 2019 Jan; 40(1):14-28. PubMed ID: 30284308
    [TBL] [Abstract][Full Text] [Related]  

  • 6. Insight into global reaction mechanism of [C2, H4, O] system from ab initio calculations by the scaled hypersphere search method.
    Yang X; Maeda S; Ohno K
    J Phys Chem A; 2007 Jun; 111(23):5099-110. PubMed ID: 17506536
    [TBL] [Abstract][Full Text] [Related]  

  • 7. Potential Energy Surface-Based Automatic Deduction of Conformational Transition Networks and Its Application on Quantum Mechanical Landscapes of d-Glucose Conformers.
    Satoh H; Oda T; Nakakoji K; Uno T; Tanaka H; Iwata S; Ohno K
    J Chem Theory Comput; 2016 Nov; 12(11):5293-5308. PubMed ID: 27673598
    [TBL] [Abstract][Full Text] [Related]  

  • 8. Cis-cis and trans-perp HOONO: action spectroscopy and isomerization kinetics.
    Fry JL; Nizkorodov SA; Okumura M; Roehl CM; Francisco JS; Wennberg PO
    J Chem Phys; 2004 Jul; 121(3):1432-48. PubMed ID: 15260688
    [TBL] [Abstract][Full Text] [Related]  

  • 9. Systematic exploration of the mechanism of chemical reactions: the global reaction route mapping (GRRM) strategy using the ADDF and AFIR methods.
    Maeda S; Ohno K; Morokuma K
    Phys Chem Chem Phys; 2013 Mar; 15(11):3683-701. PubMed ID: 23389653
    [TBL] [Abstract][Full Text] [Related]  

  • 10. Structure of the boronic acid dimer and the relative stabilities of its conformers.
    Larkin JD; Bhat KL; Markham GD; Brooks BR; Schaefer HF; Bock CW
    J Phys Chem A; 2006 Sep; 110(36):10633-42. PubMed ID: 16956246
    [TBL] [Abstract][Full Text] [Related]  

  • 11. Global reaction route mapping of isomerization pathways of exotic C6H molecular species.
    Vikas ; Kaur G
    J Chem Phys; 2013 Dec; 139(22):224311. PubMed ID: 24341596
    [TBL] [Abstract][Full Text] [Related]  

  • 12. Mechanistic aspects of the dehydration and dehydrohalogenation of halo-hydroxyformaldoxime conformers. A quantum chemical model study.
    Tsipis AC; Tsipis CA
    J Comput Chem; 2002 Oct; 23(13):1266-80. PubMed ID: 12210152
    [TBL] [Abstract][Full Text] [Related]  

  • 13. Global mapping of equilibrium and transition structures on potential energy surfaces by the scaled hypersphere search method: applications to ab initio surfaces of formaldehyde and propyne molecules.
    Maeda S; Ohno K
    J Phys Chem A; 2005 Jun; 109(25):5742-53. PubMed ID: 16833907
    [TBL] [Abstract][Full Text] [Related]  

  • 14. Ab initio global potential-energy surface for H5(+) --> H3(+) + H2.
    Xie Z; Braams BJ; Bowman JM
    J Chem Phys; 2005 Jun; 122(22):224307. PubMed ID: 15974668
    [TBL] [Abstract][Full Text] [Related]  

  • 15. Quantum mechanical study of the potential energy surface of the ClO + NO2 reaction.
    Kovacic S; Lesar A; Hodoscek M
    J Chem Inf Model; 2005; 45(1):58-64. PubMed ID: 15667129
    [TBL] [Abstract][Full Text] [Related]  

  • 16. A microwave and quantum chemical study of the conformational properties and intramolecular hydrogen bonding of 1-fluorocyclopropanecarboxylic acid.
    Møllendal H; Leonov A; de Meijere A
    J Phys Chem A; 2005 Jul; 109(28):6344-50. PubMed ID: 16833977
    [TBL] [Abstract][Full Text] [Related]  

  • 17. Hydroxyl radical recycling in isoprene oxidation driven by hydrogen bonding and hydrogen tunneling: the upgraded LIM1 mechanism.
    Peeters J; Müller JF; Stavrakou T; Nguyen VS
    J Phys Chem A; 2014 Sep; 118(38):8625-43. PubMed ID: 25010574
    [TBL] [Abstract][Full Text] [Related]  

  • 18. Ab initio potential energy and dipole moment surfaces of (H2O)2.
    Huang X; Braams BJ; Bowman JM
    J Phys Chem A; 2006 Jan; 110(2):445-51. PubMed ID: 16405316
    [TBL] [Abstract][Full Text] [Related]  

  • 19. An Automated and Systematic Transition Structure Explorer in Large Flexible Molecular Systems Based on Combined Global Reaction Route Mapping and Microiteration Methods.
    Maeda S; Ohno K; Morokuma K
    J Chem Theory Comput; 2009 Oct; 5(10):2734-43. PubMed ID: 26631786
    [TBL] [Abstract][Full Text] [Related]  

  • 20. Theoretical insight into the wavelength-dependent photodissociation mechanism of nitric acid.
    Xiao H; Maeda S; Morokuma K
    Phys Chem Chem Phys; 2016 Sep; 18(35):24582-90. PubMed ID: 27538805
    [TBL] [Abstract][Full Text] [Related]  

    [Next]    [New Search]
    of 6.