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 *

148 related articles for article (PubMed ID: 28944392)

  • 1. Bonding and spectroscopic analyses of N
    Begum S; Subramanian R
    Phys Chem Chem Phys; 2017 Oct; 19(38):26412-26422. PubMed ID: 28944392
    [TBL] [Abstract][Full Text] [Related]  

  • 2. Bonding and spectroscopic properties of complexes of SO₂-O₂ and SO₂-N₂ and its atmospheric consequences.
    Begum S; Subramanian R
    Phys Chem Chem Phys; 2014 Sep; 16(33):17658-69. PubMed ID: 25028064
    [TBL] [Abstract][Full Text] [Related]  

  • 3. A theoretical investigation of the energetics and spectroscopic properties of the gas-phase linear proton-bound cation-molecule complexes, XCH(+)-N2 (X = O, S).
    Begum S; Subramanian R
    J Mol Model; 2016 Jan; 22(1):6. PubMed ID: 26645810
    [TBL] [Abstract][Full Text] [Related]  

  • 4. Highly accurate CCSD(T) and DFT-SAPT stabilization energies of H-bonded and stacked structures of the uracil dimer.
    Pitonák M; Riley KE; Neogrády P; Hobza P
    Chemphyschem; 2008 Aug; 9(11):1636-44. PubMed ID: 18574830
    [TBL] [Abstract][Full Text] [Related]  

  • 5. On the nature of stabilization in weak, medium, and strong charge-transfer complexes: CCSD(T)/CBS and SAPT calculations.
    Karthikeyan S; Sedlak R; Hobza P
    J Phys Chem A; 2011 Sep; 115(34):9422-8. PubMed ID: 21375294
    [TBL] [Abstract][Full Text] [Related]  

  • 6. Ab initio and DFT studies on van der Waals trimers: the OCS.(CO2)2 complexes.
    Valdés H; Sordo JA
    J Comput Chem; 2002 Mar; 23(4):444-55. PubMed ID: 11908080
    [TBL] [Abstract][Full Text] [Related]  

  • 7. Characterization of the potential energy surfaces of two small but challenging noncovalent dimers: (P2 )2 and (PCCP)2.
    Van Dornshuld E; Tschumper GS
    J Comput Chem; 2014 Mar; 35(6):479-87. PubMed ID: 24403058
    [TBL] [Abstract][Full Text] [Related]  

  • 8. Theoretical study on the properties and stabilities of complexes formed between SO4(C2v) and isostructure species of CO2, CS2, and SCO.
    Seif A; Massahi S
    J Mol Model; 2014 Nov; 20(11):2488. PubMed ID: 25337685
    [TBL] [Abstract][Full Text] [Related]  

  • 9. True stabilization energies for the optimal planar hydrogen-bonded and stacked structures of guanine...cytosine, adenine...thymine, and their 9- and 1-methyl derivatives: complete basis set calculations at the MP2 and CCSD(T) levels and comparison with experiment.
    Jurecka P; Hobza P
    J Am Chem Soc; 2003 Dec; 125(50):15608-13. PubMed ID: 14664608
    [TBL] [Abstract][Full Text] [Related]  

  • 10. Ab initio study of hydrogen-bond formation between aliphatic and phenolic hydroxy groups and selected amino acid side chains.
    Nagy PI; Erhardt PW
    J Phys Chem A; 2008 May; 112(18):4342-54. PubMed ID: 18373368
    [TBL] [Abstract][Full Text] [Related]  

  • 11. Estimated MP2 and CCSD(T) interaction energies of n-alkane dimers at the basis set limit: comparison of the methods of Helgaker et al. and Feller.
    Tsuzuki S; Honda K; Uchimaru T; Mikami M
    J Chem Phys; 2006 Mar; 124(11):114304. PubMed ID: 16555885
    [TBL] [Abstract][Full Text] [Related]  

  • 12. First vibrational investigations of N
    Soulard P; Goubet M; Tremblay B
    J Chem Phys; 2018 Nov; 149(17):174311. PubMed ID: 30408970
    [TBL] [Abstract][Full Text] [Related]  

  • 13. Theoretical investigation of gas-phase molecular complex formation between 2-hydroxy thiophenol and a water molecule.
    Kumar Deb D; Sarkar B
    Phys Chem Chem Phys; 2017 Jan; 19(3):2466-2478. PubMed ID: 28058433
    [TBL] [Abstract][Full Text] [Related]  

  • 14. Stabilisation energy of C(6)H(6)...C(6)X(6) (X = F, Cl, Br, I, CN) complexes: complete basis set limit calculations at MP2 and CCSD(T) levels.
    Pluhácková K; Jurecka P; Hobza P
    Phys Chem Chem Phys; 2007 Feb; 9(6):755-60. PubMed ID: 17268688
    [TBL] [Abstract][Full Text] [Related]  

  • 15. Benchmark theoretical study of the π-π binding energy in the benzene dimer.
    Miliordos E; Aprà E; Xantheas SS
    J Phys Chem A; 2014 Sep; 118(35):7568-78. PubMed ID: 24761749
    [TBL] [Abstract][Full Text] [Related]  

  • 16. Approximations to complete basis set-extrapolated, highly correlated non-covalent interaction energies.
    Mackie ID; DiLabio GA
    J Chem Phys; 2011 Oct; 135(13):134318. PubMed ID: 21992316
    [TBL] [Abstract][Full Text] [Related]  

  • 17. Calculations on noncovalent interactions and databases of benchmark interaction energies.
    Hobza P
    Acc Chem Res; 2012 Apr; 45(4):663-72. PubMed ID: 22225511
    [TBL] [Abstract][Full Text] [Related]  

  • 18. Characterization of OCS-HCCCCH and N
    Barclay AJ; Pietropolli Charmet A; Michaelian KH; Moazzen-Ahmadi N
    J Phys Chem A; 2018 Jun; 122(24):5383-5390. PubMed ID: 29809008
    [TBL] [Abstract][Full Text] [Related]  

  • 19. A comparison of ab initio quantum-mechanical and experimental D0 binding energies of eleven H-bonded and eleven dispersion-bound complexes.
    Haldar S; Gnanasekaran R; Hobza P
    Phys Chem Chem Phys; 2015 Oct; 17(40):26645-52. PubMed ID: 26392236
    [TBL] [Abstract][Full Text] [Related]  

  • 20. Isomers of the uracil dimer: an ab initio benchmark study.
    Frey JA; Müller A; Losada M; Leutwyler S
    J Phys Chem B; 2007 Apr; 111(13):3534-42. PubMed ID: 17388514
    [TBL] [Abstract][Full Text] [Related]  

    [Next]    [New Search]
    of 8.