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PUBMED FOR HANDHELDS

Journal Abstract Search


365 related items for PubMed ID: 26574389

  • 1. Accuracy of Protein Embedding Potentials: An Analysis in Terms of Electrostatic Potentials.
    Olsen JM, List NH, Kristensen K, Kongsted J.
    J Chem Theory Comput; 2015 Apr 14; 11(4):1832-42. PubMed ID: 26574389
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  • 7. Effect of protein environment within cytochrome P450cam evaluated using a polarizable-embedding QM/MM method.
    Thellamurege NM, Hirao H.
    J Phys Chem B; 2014 Feb 27; 118(8):2084-92. PubMed ID: 24484442
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  • 9. Electrostatic embedding in large-scale first principles quantum mechanical calculations on biomolecules.
    Fox SJ, Pittock C, Fox T, Tautermann CS, Malcolm N, Skylaris CK.
    J Chem Phys; 2011 Dec 14; 135(22):224107. PubMed ID: 22168680
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  • 11. Toward Building Protein Force Fields by Residue-Based Systematic Molecular Fragmentation and Neural Network.
    Wang H, Yang W.
    J Chem Theory Comput; 2019 Feb 12; 15(2):1409-1417. PubMed ID: 30550274
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  • 12. Quantum Fragment Based ab Initio Molecular Dynamics for Proteins.
    Liu J, Zhu T, Wang X, He X, Zhang JZ.
    J Chem Theory Comput; 2015 Dec 08; 11(12):5897-905. PubMed ID: 26642993
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  • 16. Nuclear Magnetic Shielding Constants from Quantum Mechanical/Molecular Mechanical Calculations Using Polarizable Embedding: Role of the Embedding Potential.
    Steinmann C, Olsen JM, Kongsted J.
    J Chem Theory Comput; 2014 Mar 11; 10(3):981-8. PubMed ID: 26580177
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  • 17. Quantum refinement of protein structures: implementation and application to the red fluorescent protein DsRed.M1.
    Hsiao YW, Sanchez-Garcia E, Doerr M, Thiel W.
    J Phys Chem B; 2010 Nov 25; 114(46):15413-23. PubMed ID: 20977248
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  • 20. Chromophore-protein coupling beyond nonpolarizable models: understanding absorption in green fluorescent protein.
    Daday C, Curutchet C, Sinicropi A, Mennucci B, Filippi C.
    J Chem Theory Comput; 2015 Oct 13; 11(10):4825-39. PubMed ID: 26574271
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