BIOMARKERS

Molecular Biopsy of Human Tumors

- a resource for Precision Medicine *

172 related articles for article (PubMed ID: 27973803)

  • 1. Ab Initio Vibrational Spectroscopy of cis- and trans-Formic Acid from a Global Potential Energy Surface.
    Tew DP; Mizukami W
    J Phys Chem A; 2016 Dec; 120(49):9815-9828. PubMed ID: 27973803
    [TBL] [Abstract][Full Text] [Related]  

  • 2. 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]  

  • 3. Variational calculations of vibrational energies and IR spectra of trans- and cis-HOCO using new ab initio potential energy and dipole moment surfaces.
    Wang Y; Carter S; Bowman JM
    J Phys Chem A; 2013 Oct; 117(39):9343-52. PubMed ID: 23151059
    [TBL] [Abstract][Full Text] [Related]  

  • 4. Anharmonic force field and vibrational dynamics of CH2F2 up to 5000 cm(-1) studied by Fourier transform infrared spectroscopy and state-of-the-art ab initio calculations.
    Tasinato N; Regini G; Stoppa P; Pietropolli Charmet A; Gambi A
    J Chem Phys; 2012 Jun; 136(21):214302. PubMed ID: 22697538
    [TBL] [Abstract][Full Text] [Related]  

  • 5. A hybrid variational-perturbation calculation of the ro-vibrational spectrum of nitric acid.
    Pavlyuchko AI; Yurchenko SN; Tennyson J
    J Chem Phys; 2015 Mar; 142(9):094309. PubMed ID: 25747083
    [TBL] [Abstract][Full Text] [Related]  

  • 6. Vibrational treatment of the formic acid double minimum case in valence coordinates.
    Richter F; Carbonnière P
    J Chem Phys; 2018 Feb; 148(6):064303. PubMed ID: 29448799
    [TBL] [Abstract][Full Text] [Related]  

  • 7. Vibrational overtone spectrum of matrix isolated cis, cis-HOONO.
    Zhang X; Nimlos MR; Ellison GB; Varner ME; Stanton JF
    J Chem Phys; 2007 May; 126(17):174308. PubMed ID: 17492864
    [TBL] [Abstract][Full Text] [Related]  

  • 8. Vibrational energies for HFCO using a neural network sum of exponentials potential energy surface.
    Pradhan E; Brown A
    J Chem Phys; 2016 May; 144(17):174305. PubMed ID: 27155638
    [TBL] [Abstract][Full Text] [Related]  

  • 9. Role of OH-stretch/torsion coupling and quantum yield effects in the first OH overtone spectrum of cis-cis HOONO.
    McCoy AB; Fry JL; Francisco JS; Mollner AK; Okumura M
    J Chem Phys; 2005 Mar; 122(10):104311. PubMed ID: 15836319
    [TBL] [Abstract][Full Text] [Related]  

  • 10. CCSD(T) study of the far-infrared spectrum of ethyl methyl ether.
    Senent ML; Ruiz R; Villa M; Domínguez-Gómez R
    J Chem Phys; 2009 Feb; 130(6):064101. PubMed ID: 19222261
    [TBL] [Abstract][Full Text] [Related]  

  • 11. Two-component, ab initio potential energy surface for CO
    Wang QK; Bowman JM
    J Chem Phys; 2017 Oct; 147(16):161714. PubMed ID: 29096492
    [TBL] [Abstract][Full Text] [Related]  

  • 12. Accurate ab initio structure, dissociation energy, and vibrational spectroscopy of the F(-)-CH4 anion complex.
    Czakó G; Braams BJ; Bowman JM
    J Phys Chem A; 2008 Aug; 112(32):7466-72. PubMed ID: 18651724
    [TBL] [Abstract][Full Text] [Related]  

  • 13. Vibrational states of deuterated trans- and cis-formic acid: DCOOH, HCOOD, and DCOOD.
    Aerts A; Carbonnière P; Richter F; Brown A
    J Chem Phys; 2020 Jan; 152(2):024305. PubMed ID: 31941335
    [TBL] [Abstract][Full Text] [Related]  

  • 14. A new accurate ground-state potential energy surface of ethylene and predictions for rotational and vibrational energy levels.
    Delahaye T; Nikitin A; Rey M; Szalay PG; Tyuterev VG
    J Chem Phys; 2014 Sep; 141(10):104301. PubMed ID: 25217910
    [TBL] [Abstract][Full Text] [Related]  

  • 15. 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]  

  • 16. Vibrational infrared and Raman spectra of HCOOH from variational computations.
    Avila G; Martín Santa Daría A; Mátyus E
    Phys Chem Chem Phys; 2023 Jun; 25(22):15183-15192. PubMed ID: 37223906
    [TBL] [Abstract][Full Text] [Related]  

  • 17. Ab Initio Potential for H
    Yu Q; Bowman JM
    J Chem Theory Comput; 2016 Nov; 12(11):5284-5292. PubMed ID: 27673756
    [TBL] [Abstract][Full Text] [Related]  

  • 18. A study of the mode-selective trans--cis isomerization in HONO using ab initio methodology.
    Richter F; Hochlaf M; Rosmus P; Gatti F; Meyer HD
    J Chem Phys; 2004 Jan; 120(3):1306-17. PubMed ID: 15268256
    [TBL] [Abstract][Full Text] [Related]  

  • 19. Anharmonic rovibrational calculations of singlet cyclic C4 using a new ab initio potential and a quartic force field.
    Wang X; Huang X; Bowman JM; Lee TJ
    J Chem Phys; 2013 Dec; 139(22):224302. PubMed ID: 24329063
    [TBL] [Abstract][Full Text] [Related]  

  • 20. A ground state potential energy surface for HONO based on a neural network with exponential fitting functions.
    Pradhan E; Brown A
    Phys Chem Chem Phys; 2017 Aug; 19(33):22272-22281. PubMed ID: 28805229
    [TBL] [Abstract][Full Text] [Related]  

    [Next]    [New Search]
    of 9.