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 *

113 related articles for article (PubMed ID: 39092936)

  • 1. A modular, composite framework for the utilization of reduced-scaling Coulomb and exchange construction algorithms: Design and implementation.
    Poole D; Williams-Young DB; Jiang A; Glick ZL; Sherrill CD
    J Chem Phys; 2024 Aug; 161(5):. PubMed ID: 39092936
    [TBL] [Abstract][Full Text] [Related]  

  • 2. Distributed memory, GPU accelerated Fock construction for hybrid, Gaussian basis density functional theory.
    Williams-Young DB; Asadchev A; Popovici DT; Clark D; Waldrop J; Windus TL; Valeev EF; de Jong WA
    J Chem Phys; 2023 Jun; 158(23):. PubMed ID: 37326157
    [TBL] [Abstract][Full Text] [Related]  

  • 3. Highly Efficient and Accurate Computation of Multiple Orbital Spaces Spanning Fock Matrix Elements on Central and Graphics Processing Units for Application in F12 Theory.
    Urban L; Laqua H; Ochsenfeld C
    J Chem Theory Comput; 2022 Jul; 18(7):4218-4228. PubMed ID: 35674337
    [TBL] [Abstract][Full Text] [Related]  

  • 4. Multinode Multi-GPU Two-Electron Integrals: Code Generation Using the Regent Language.
    Johnson KG; Mirchandaney S; Hoag E; Heirich A; Aiken A; Martínez TJ
    J Chem Theory Comput; 2022 Nov; 18(11):6522-6536. PubMed ID: 36200649
    [TBL] [Abstract][Full Text] [Related]  

  • 5. GPU algorithms for density matrix methods on MOPAC: linear scaling electronic structure calculations for large molecular systems.
    Maia JDC; Dos Anjos Formiga Cabral L; Rocha GB
    J Mol Model; 2020 Oct; 26(11):313. PubMed ID: 33090341
    [TBL] [Abstract][Full Text] [Related]  

  • 6. Highly Efficient Resolution-of-Identity Density Functional Theory Calculations on Central and Graphics Processing Units.
    Kussmann J; Laqua H; Ochsenfeld C
    J Chem Theory Comput; 2021 Mar; 17(3):1512-1521. PubMed ID: 33615784
    [TBL] [Abstract][Full Text] [Related]  

  • 7. Parallel beamlet dose calculation via beamlet contexts in a distributed multi-GPU framework.
    Neph R; Ouyang C; Neylon J; Yang Y; Sheng K
    Med Phys; 2019 Aug; 46(8):3719-3733. PubMed ID: 31183871
    [TBL] [Abstract][Full Text] [Related]  

  • 8. Faster Self-Consistent Field (SCF) Calculations on GPU Clusters.
    Barca GMJ; Alkan M; Galvez-Vallejo JL; Poole DL; Rendell AP; Gordon MS
    J Chem Theory Comput; 2021 Dec; 17(12):7486-7503. PubMed ID: 34780186
    [TBL] [Abstract][Full Text] [Related]  

  • 9. A hybrid CPU/GPU method for Hartree-Fock self-consistent-field calculation.
    Qi J; Zhang Y; Yang M
    J Chem Phys; 2023 Sep; 159(10):. PubMed ID: 37681693
    [TBL] [Abstract][Full Text] [Related]  

  • 10. Hybrid CPU/GPU Integral Engine for Strong-Scaling Ab Initio Methods.
    Kussmann J; Ochsenfeld C
    J Chem Theory Comput; 2017 Jul; 13(7):3153-3159. PubMed ID: 28636392
    [TBL] [Abstract][Full Text] [Related]  

  • 11. Linear scaling computation of the Fock matrix. VII. Periodic density functional theory at the Gamma point.
    Tymczak CJ; Challacombe M
    J Chem Phys; 2005 Apr; 122(13):134102. PubMed ID: 15847450
    [TBL] [Abstract][Full Text] [Related]  

  • 12. Multi-GPU implementation of a VMAT treatment plan optimization algorithm.
    Tian Z; Peng F; Folkerts M; Tan J; Jia X; Jiang SB
    Med Phys; 2015 Jun; 42(6):2841-52. PubMed ID: 26127037
    [TBL] [Abstract][Full Text] [Related]  

  • 13. Screening methods for linear-scaling short-range hybrid calculations on CPU and GPU architectures.
    Beuerle M; Kussmann J; Ochsenfeld C
    J Chem Phys; 2017 Apr; 146(14):144108. PubMed ID: 28411611
    [TBL] [Abstract][Full Text] [Related]  

  • 14. Efficient periodic resolution-of-the-identity Hartree-Fock exchange method with k-point sampling and Gaussian basis sets.
    Bussy A; Hutter J
    J Chem Phys; 2024 Feb; 160(6):. PubMed ID: 38353305
    [TBL] [Abstract][Full Text] [Related]  

  • 15. Quantum supercharger library: hyper-parallelism of the Hartree-Fock method.
    Fernandes KD; Renison CA; Naidoo KJ
    J Comput Chem; 2015 Jul; 36(18):1399-409. PubMed ID: 25975763
    [TBL] [Abstract][Full Text] [Related]  

  • 16. Large-scale Dirac-Fock-Breit method using density fitting and 2-spinor basis functions.
    Kelley MS; Shiozaki T
    J Chem Phys; 2013 May; 138(20):204113. PubMed ID: 23742460
    [TBL] [Abstract][Full Text] [Related]  

  • 17. Communication: A reduced scaling J-engine based reformulation of SOS-MP2 using graphics processing units.
    Maurer SA; Kussmann J; Ochsenfeld C
    J Chem Phys; 2014 Aug; 141(5):051106. PubMed ID: 25106563
    [TBL] [Abstract][Full Text] [Related]  

  • 18. NMF-mGPU: non-negative matrix factorization on multi-GPU systems.
    Mejía-Roa E; Tabas-Madrid D; Setoain J; García C; Tirado F; Pascual-Montano A
    BMC Bioinformatics; 2015 Feb; 16():43. PubMed ID: 25887585
    [TBL] [Abstract][Full Text] [Related]  

  • 19. Accelerating seminumerical Fock-exchange calculations using mixed single- and double-precision arithmethic.
    Laqua H; Kussmann J; Ochsenfeld C
    J Chem Phys; 2021 Jun; 154(21):214116. PubMed ID: 34240990
    [TBL] [Abstract][Full Text] [Related]  

  • 20. Arbitrary Angular Momentum Electron Repulsion Integrals with Graphical Processing Units: Application to the Resolution of Identity Hartree-Fock Method.
    Kalinowski J; Wennmohs F; Neese F
    J Chem Theory Comput; 2017 Jul; 13(7):3160-3170. PubMed ID: 28605592
    [TBL] [Abstract][Full Text] [Related]  

    [Next]    [New Search]
    of 6.