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 *

145 related articles for article (PubMed ID: 28898080)

  • 1. Efficient Reconstruction of CAS-CI-Type Wave Functions for a DMRG State Using Quantum Information Theory and a Genetic Algorithm.
    Luo Z; Ma Y; Liu C; Ma H
    J Chem Theory Comput; 2017 Oct; 13(10):4699-4710. PubMed ID: 28898080
    [TBL] [Abstract][Full Text] [Related]  

  • 2. Portably parallel construction of a configuration-interaction wave function from a matrix-product state using the Charm++ framework.
    Wang T; Ma Y; Zhao L; Jiang J
    J Comput Chem; 2020 Dec; 41(32):2707-2721. PubMed ID: 32986283
    [TBL] [Abstract][Full Text] [Related]  

  • 3. Accurate ab Initio Spin Densities.
    Boguslawski K; Marti KH; Legeza O; Reiher M
    J Chem Theory Comput; 2012 Jun; 8(6):1970-1982. PubMed ID: 22707921
    [TBL] [Abstract][Full Text] [Related]  

  • 4. Construction of CASCI-type wave functions for very large active spaces.
    Boguslawski K; Marti KH; Reiher M
    J Chem Phys; 2011 Jun; 134(22):224101. PubMed ID: 21682501
    [TBL] [Abstract][Full Text] [Related]  

  • 5. Linear response theory for the density matrix renormalization group: efficient algorithms for strongly correlated excited states.
    Nakatani N; Wouters S; Van Neck D; Chan GK
    J Chem Phys; 2014 Jan; 140(2):024108. PubMed ID: 24437866
    [TBL] [Abstract][Full Text] [Related]  

  • 6. A Perturbative Density Matrix Renormalization Group Algorithm for Large Active Spaces.
    Guo S; Li Z; Chan GK
    J Chem Theory Comput; 2018 Aug; 14(8):4063-4071. PubMed ID: 29927592
    [TBL] [Abstract][Full Text] [Related]  

  • 7. Hilbert space renormalization for the many-electron problem.
    Li Z; Chan GK
    J Chem Phys; 2016 Feb; 144(8):084103. PubMed ID: 26931677
    [TBL] [Abstract][Full Text] [Related]  

  • 8. Density-matrix renormalization group algorithm with multi-level active space.
    Ma Y; Wen J; Ma H
    J Chem Phys; 2015 Jul; 143(3):034105. PubMed ID: 26203012
    [TBL] [Abstract][Full Text] [Related]  

  • 9. Efficient Relativistic Density-Matrix Renormalization Group Implementation in a Matrix-Product Formulation.
    Battaglia S; Keller S; Knecht S
    J Chem Theory Comput; 2018 May; 14(5):2353-2369. PubMed ID: 29558618
    [TBL] [Abstract][Full Text] [Related]  

  • 10. Multireference Ab Initio Density Matrix Renormalization Group (DMRG)-CASSCF and DMRG-CASPT2 Study on the Photochromic Ring Opening of Spiropyran.
    Liu F; Kurashige Y; Yanai T; Morokuma K
    J Chem Theory Comput; 2013 Oct; 9(10):4462-9. PubMed ID: 26589164
    [TBL] [Abstract][Full Text] [Related]  

  • 11. Complete active space second-order perturbation theory with cumulant approximation for extended active-space wavefunction from density matrix renormalization group.
    Kurashige Y; Chalupský J; Lan TN; Yanai T
    J Chem Phys; 2014 Nov; 141(17):174111. PubMed ID: 25381506
    [TBL] [Abstract][Full Text] [Related]  

  • 12. Multistate Complete-Active-Space Second-Order Perturbation Theory Based on Density Matrix Renormalization Group Reference States.
    Yanai T; Saitow M; Xiong XG; Chalupský J; Kurashige Y; Guo S; Sharma S
    J Chem Theory Comput; 2017 Oct; 13(10):4829-4840. PubMed ID: 28881132
    [TBL] [Abstract][Full Text] [Related]  

  • 13. High-performance ab initio density matrix renormalization group method: applicability to large-scale multireference problems for metal compounds.
    Kurashige Y; Yanai T
    J Chem Phys; 2009 Jun; 130(23):234114. PubMed ID: 19548718
    [TBL] [Abstract][Full Text] [Related]  

  • 14. Externally-Contracted Multireference Configuration Interaction Method Using a DMRG Reference Wave Function.
    Luo Z; Ma Y; Wang X; Ma H
    J Chem Theory Comput; 2018 Sep; 14(9):4747-4755. PubMed ID: 30052433
    [TBL] [Abstract][Full Text] [Related]  

  • 15. Fully Internally Contracted Multireference Configuration Interaction Theory Using Density Matrix Renormalization Group: A Reduced-Scaling Implementation Derived by Computer-Aided Tensor Factorization.
    Saitow M; Kurashige Y; Yanai T
    J Chem Theory Comput; 2015 Nov; 11(11):5120-31. PubMed ID: 26574310
    [TBL] [Abstract][Full Text] [Related]  

  • 16. Kylin 1.0: An ab-initio density matrix renormalization group quantum chemistry program.
    Xie Z; Song Y; Peng F; Li J; Cheng Y; Zhang L; Ma Y; Tian Y; Luo Z; Ma H
    J Comput Chem; 2023 May; 44(13):1316-1328. PubMed ID: 36809661
    [TBL] [Abstract][Full Text] [Related]  

  • 17. The density matrix renormalization group self-consistent field method: orbital optimization with the density matrix renormalization group method in the active space.
    Zgid D; Nooijen M
    J Chem Phys; 2008 Apr; 128(14):144116. PubMed ID: 18412432
    [TBL] [Abstract][Full Text] [Related]  

  • 18. Excited-State Geometry Optimization with the Density Matrix Renormalization Group, as Applied to Polyenes.
    Hu W; Chan GK
    J Chem Theory Comput; 2015 Jul; 11(7):3000-9. PubMed ID: 26575737
    [TBL] [Abstract][Full Text] [Related]  

  • 19. Quantum Proton Effects from Density Matrix Renormalization Group Calculations.
    Feldmann R; Muolo A; Baiardi A; Reiher M
    J Chem Theory Comput; 2022 Jan; 18(1):234-250. PubMed ID: 34978441
    [TBL] [Abstract][Full Text] [Related]  

  • 20. A Deterministic Projector Configuration Interaction Approach for the Ground State of Quantum Many-Body Systems.
    Zhang T; Evangelista FA
    J Chem Theory Comput; 2016 Sep; 12(9):4326-37. PubMed ID: 27464301
    [TBL] [Abstract][Full Text] [Related]  

    [Next]    [New Search]
    of 8.