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 *

267 related articles for article (PubMed ID: 17129112)

  • 1. A quantum-classical approach to the molecular dynamics of pyrazine with a realistic model Hamiltonian.
    Puzari P; Sarkar B; Adhikari S
    J Chem Phys; 2006 Nov; 125(19):194316. PubMed ID: 17129112
    [TBL] [Abstract][Full Text] [Related]  

  • 2. A quantum-classical approach to the molecular dynamics of butatriene cation with a realistic model Hamiltonian.
    Sardar S; Paul AK; Mondal P; Sarkar B; Adhikari S
    Phys Chem Chem Phys; 2008 Nov; 10(42):6388-98. PubMed ID: 18972027
    [TBL] [Abstract][Full Text] [Related]  

  • 3. A quantum-classical approach to the photoabsorption spectrum of pyrazine.
    Puzari P; Swathi RS; Sarkar B; Adhikari S
    J Chem Phys; 2005 Oct; 123(13):134317. PubMed ID: 16223298
    [TBL] [Abstract][Full Text] [Related]  

  • 4. The multistate multimode vibronic dynamics of benzene radical cation with a realistic model Hamiltonian using a parallelized algorithm of the quantumclassical approach.
    Sardar S; Paul AK; Sharma R; Adhikari S
    J Chem Phys; 2009 Apr; 130(14):144302. PubMed ID: 19368440
    [TBL] [Abstract][Full Text] [Related]  

  • 5. Multi-state multi-mode nuclear dynamics on three isomers of C6H4F2+ using parallelized TDDVR approach.
    Sardar S; Puzari P; Adhikari S
    Phys Chem Chem Phys; 2011 Sep; 13(35):15960-72. PubMed ID: 21826347
    [TBL] [Abstract][Full Text] [Related]  

  • 6. Does ℏ play a role in multidimensional spectroscopy? Reduced hierarchy equations of motion approach to molecular vibrations.
    Sakurai A; Tanimura Y
    J Phys Chem A; 2011 Apr; 115(16):4009-22. PubMed ID: 21247206
    [TBL] [Abstract][Full Text] [Related]  

  • 7. A local coherent-state approximation to system-bath quantum dynamics.
    Martinazzo R; Nest M; Saalfrank P; Tantardini GF
    J Chem Phys; 2006 Nov; 125(19):194102. PubMed ID: 17129084
    [TBL] [Abstract][Full Text] [Related]  

  • 8. Modeling, calculating, and analyzing multidimensional vibrational spectroscopies.
    Tanimura Y; Ishizaki A
    Acc Chem Res; 2009 Sep; 42(9):1270-9. PubMed ID: 19441802
    [TBL] [Abstract][Full Text] [Related]  

  • 9. Real time quantum propagation on a Monte Carlo trajectory guided grids of coupled coherent states: 26D simulation of pyrazine absorption spectrum.
    Shalashilin DV; Child MS
    J Chem Phys; 2004 Aug; 121(8):3563-8. PubMed ID: 15303922
    [TBL] [Abstract][Full Text] [Related]  

  • 10. Dissipative quantum dynamics with the surrogate Hamiltonian approach. A comparison between spin and harmonic baths.
    Gelman D; Koch CP; Kosloff R
    J Chem Phys; 2004 Jul; 121(2):661-71. PubMed ID: 15260592
    [TBL] [Abstract][Full Text] [Related]  

  • 11. Quantum simulation of solution phase intramolecular electron transfer rates in betaine-30.
    Kim H; Hwang H; Rossky PJ
    J Phys Chem A; 2006 Oct; 110(39):11223-9. PubMed ID: 17004730
    [TBL] [Abstract][Full Text] [Related]  

  • 12. The roles of electronic exchange and correlation in charge-transfer- to-solvent dynamics: Many-electron nonadiabatic mixed quantum/classical simulations of photoexcited sodium anions in the condensed phase.
    Glover WJ; Larsen RE; Schwartz BJ
    J Chem Phys; 2008 Oct; 129(16):164505. PubMed ID: 19045282
    [TBL] [Abstract][Full Text] [Related]  

  • 13. Effective-mode representation of non-Markovian dynamics: a hierarchical approximation of the spectral density. II. Application to environment-induced nonadiabatic dynamics.
    Hughes KH; Christ CD; Burghardt I
    J Chem Phys; 2009 Sep; 131(12):124108. PubMed ID: 19791853
    [TBL] [Abstract][Full Text] [Related]  

  • 14. Quantum mechanical and quasiclassical investigations of the time domain nonadiabatic dynamics of NO2 close to the bottom of the X 2A1 - A 2B2 conical intersection.
    Sanrey M; Joyeux M
    J Chem Phys; 2006 Jul; 125(1):014304. PubMed ID: 16863295
    [TBL] [Abstract][Full Text] [Related]  

  • 15. Quantum vibrational state-dependent potentials for classical many-body simulations.
    Riga JM; Fredj E; Martens CC
    J Chem Phys; 2005 May; 122(17):174107. PubMed ID: 15910023
    [TBL] [Abstract][Full Text] [Related]  

  • 16. Separation of time scale and coupling in the motion governed by the coarse-grained and fine degrees of freedom in a polypeptide backbone.
    Murarka RK; Liwo A; Scheraga HA
    J Chem Phys; 2007 Oct; 127(15):155103. PubMed ID: 17949219
    [TBL] [Abstract][Full Text] [Related]  

  • 17. The effect of phonon modes on the H2(v, j)/D2(v, j)-Cu(1nn) scattering processes.
    Sahoo T; Sardar S; Adhikari S
    Phys Chem Chem Phys; 2011 Jun; 13(21):10100-10. PubMed ID: 21509364
    [TBL] [Abstract][Full Text] [Related]  

  • 18. Quantum wave packet ab initio molecular dynamics: an approach to study quantum dynamics in large systems.
    Iyengar SS; Jakowski J
    J Chem Phys; 2005 Mar; 122(11):114105. PubMed ID: 15836199
    [TBL] [Abstract][Full Text] [Related]  

  • 19. Quantum-classical description of environmental effects on electronic dynamics at conical intersections.
    Kelly A; Kapral R
    J Chem Phys; 2010 Aug; 133(8):084502. PubMed ID: 20815575
    [TBL] [Abstract][Full Text] [Related]  

  • 20. Nonadiabatic quantum dynamics based on a hierarchical electron-phonon model: exciton dissociation in semiconducting polymers.
    Tamura H; Bittner ER; Burghardt I
    J Chem Phys; 2007 Jul; 127(3):034706. PubMed ID: 17655454
    [TBL] [Abstract][Full Text] [Related]  

    [Next]    [New Search]
    of 14.