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 *

108 related articles for article (PubMed ID: 38566485)

  • 1. A reinvestigation of the boron cluster B
    Jeilani YA; Van Duong L; Al Qahtani OMS; Nguyen MT
    Phys Chem Chem Phys; 2024 Apr; 26(15):11347-11359. PubMed ID: 38566485
    [TBL] [Abstract][Full Text] [Related]  

  • 2. Assessment of the accuracy of density functionals for prediction of relative energies and geometries of low-lying isomers of water hexamers.
    Dahlke EE; Olson RM; Leverentz HR; Truhlar DG
    J Phys Chem A; 2008 May; 112(17):3976-84. PubMed ID: 18393474
    [TBL] [Abstract][Full Text] [Related]  

  • 3. Boron Silicon B
    Duong LV; Tri NN; Hung NP; Nguyen MT
    J Phys Chem A; 2022 May; 126(20):3101-3109. PubMed ID: 35548930
    [TBL] [Abstract][Full Text] [Related]  

  • 4. Size effects and electronic properties of zinc-doped boron clusters Zn
    Ren RQ; Long ZW; Li SX; Gao CG
    J Mol Model; 2024 Apr; 30(5):123. PubMed ID: 38573432
    [TBL] [Abstract][Full Text] [Related]  

  • 5. Low-lying isomers of the B9(-) boron cluster: the planar molecular wheel versus three-dimensional structures.
    Pan LL; Li J; Wang LS
    J Chem Phys; 2008 Jul; 129(2):024302. PubMed ID: 18624528
    [TBL] [Abstract][Full Text] [Related]  

  • 6. A photoelectron spectroscopy and ab initio study of the structures and chemical bonding of the B25(-) cluster.
    Piazza ZA; Popov IA; Li WL; Pal R; Zeng XC; Boldyrev AI; Wang LS
    J Chem Phys; 2014 Jul; 141(3):034303. PubMed ID: 25053316
    [TBL] [Abstract][Full Text] [Related]  

  • 7. Do Practical Standard Coupled Cluster Calculations Agree Better than Kohn-Sham Calculations with Currently Available Functionals When Compared to the Best Available Experimental Data for Dissociation Energies of Bonds to 3d Transition Metals?
    Xu X; Zhang W; Tang M; Truhlar DG
    J Chem Theory Comput; 2015 May; 11(5):2036-52. PubMed ID: 26574408
    [TBL] [Abstract][Full Text] [Related]  

  • 8. A critical comparison of CH⋯π
    Herman KM; Aprà E; Xantheas SS
    Phys Chem Chem Phys; 2023 Feb; 25(6):4824-4838. PubMed ID: 36692338
    [TBL] [Abstract][Full Text] [Related]  

  • 9. A photoelectron spectroscopy and ab initio study of B21-: negatively charged boron clusters continue to be planar at 21.
    Piazza ZA; Li WL; Romanescu C; Sergeeva AP; Wang LS; Boldyrev AI
    J Chem Phys; 2012 Mar; 136(10):104310. PubMed ID: 22423841
    [TBL] [Abstract][Full Text] [Related]  

  • 10. Competition between quasi-planar and cage-like structures in the B
    Li HR; Jian T; Li WL; Miao CQ; Wang YJ; Chen Q; Luo XM; Wang K; Zhai HJ; Li SD; Wang LS
    Phys Chem Chem Phys; 2016 Oct; 18(42):29147-29155. PubMed ID: 27730232
    [TBL] [Abstract][Full Text] [Related]  

  • 11. Is It Possible To Obtain Coupled Cluster Quality Energies at near Density Functional Theory Cost? Domain-Based Local Pair Natural Orbital Coupled Cluster vs Modern Density Functional Theory.
    Liakos DG; Neese F
    J Chem Theory Comput; 2015 Sep; 11(9):4054-63. PubMed ID: 26575901
    [TBL] [Abstract][Full Text] [Related]  

  • 12. Ab initio molecular-orbital study of structures and energetics of Si3H3 neutral and anion.
    Saitoh T; Naoe T; Ikuta S
    J Chem Phys; 2005 May; 122(20):204314. PubMed ID: 15945731
    [TBL] [Abstract][Full Text] [Related]  

  • 13. Pi and sigma-phenylethynyl radicals and their isomers o-, m-, and p-ethynylphenyl: structures, energetics, and electron affinities.
    Sreeruttun RK; Ramasami P; Wannere CS; Simmonett AC; Schaefer HF
    J Phys Chem A; 2008 Apr; 112(13):2838-45. PubMed ID: 18335906
    [TBL] [Abstract][Full Text] [Related]  

  • 14. Relative stability of planar versus double-ring tubular isomers of neutral and anionic boron cluster B20 and B20-.
    An W; Bulusu S; Gao Y; Zeng XC
    J Chem Phys; 2006 Apr; 124(15):154310. PubMed ID: 16674229
    [TBL] [Abstract][Full Text] [Related]  

  • 15. CCSD(T) Rotational Constants for Highly Challenging C
    Thimmakondu VS; Karton A
    Molecules; 2023 Sep; 28(18):. PubMed ID: 37764314
    [TBL] [Abstract][Full Text] [Related]  

  • 16. Density functional study of multiplicity-changing valence and Rydberg excitations of p-block elements: delta self-consistent field, collinear spin-flip time-dependent density functional theory (DFT), and conventional time-dependent DFT.
    Yang K; Peverati R; Truhlar DG; Valero R
    J Chem Phys; 2011 Jul; 135(4):044118. PubMed ID: 21806101
    [TBL] [Abstract][Full Text] [Related]  

  • 17. Benchmarking DFT Functionals for Excited-State Calculations of Donor-Acceptor TADF Emitters: Insights on the Key Parameters Determining Reverse Inter-System Crossing.
    Hall D; Sancho-García JC; Pershin A; Beljonne D; Zysman-Colman E; Olivier Y
    J Phys Chem A; 2023 Jun; 127(21):4743-4757. PubMed ID: 37196185
    [TBL] [Abstract][Full Text] [Related]  

  • 18. 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]  

  • 19. Predicting Ligand-Dissociation Energies of 3d Coordination Complexes with Auxiliary-Field Quantum Monte Carlo.
    Rudshteyn B; Coskun D; Weber JL; Arthur EJ; Zhang S; Reichman DR; Friesner RA; Shee J
    J Chem Theory Comput; 2020 May; 16(5):3041-3054. PubMed ID: 32293882
    [TBL] [Abstract][Full Text] [Related]  

  • 20. Comparison of DFT methods for molecular orbital eigenvalue calculations.
    Zhang G; Musgrave CB
    J Phys Chem A; 2007 Mar; 111(8):1554-61. PubMed ID: 17279730
    [TBL] [Abstract][Full Text] [Related]  

    [Next]    [New Search]
    of 6.