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366 related items for PubMed ID: 20441257

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  • 2. The multiscale coarse-graining method. III. A test of pairwise additivity of the coarse-grained potential and of new basis functions for the variational calculation.
    Das A, Andersen HC.
    J Chem Phys; 2009 Jul 21; 131(3):034102. PubMed ID: 19624176
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  • 3. Effective force coarse-graining.
    Wang Y, Noid WG, Liu P, Voth GA.
    Phys Chem Chem Phys; 2009 Mar 28; 11(12):2002-15. PubMed ID: 19280011
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  • 4. The multiscale coarse-graining method. IX. A general method for construction of three body coarse-grained force fields.
    Das A, Andersen HC.
    J Chem Phys; 2012 May 21; 136(19):194114. PubMed ID: 22612087
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  • 6. The multiscale coarse-graining method. X. Improved algorithms for constructing coarse-grained potentials for molecular systems.
    Das A, Lu L, Andersen HC, Voth GA.
    J Chem Phys; 2012 May 21; 136(19):194115. PubMed ID: 22612088
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  • 8. Multiscale coarse-graining of ionic liquids.
    Wang Y, Izvekov S, Yan T, Voth GA.
    J Phys Chem B; 2006 Mar 02; 110(8):3564-75. PubMed ID: 16494412
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  • 9. The multiscale coarse-graining method: assessing its accuracy and introducing density dependent coarse-grain potentials.
    Izvekov S, Chung PW, Rice BM.
    J Chem Phys; 2010 Aug 14; 133(6):064109. PubMed ID: 20707563
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  • 10. Mixed atomistic and coarse-grained molecular dynamics: simulation of a membrane-bound ion channel.
    Shi Q, Izvekov S, Voth GA.
    J Phys Chem B; 2006 Aug 10; 110(31):15045-8. PubMed ID: 16884212
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  • 12. The multiscale coarse-graining method. VII. Free energy decomposition of coarse-grained effective potentials.
    Lu L, Voth GA.
    J Chem Phys; 2011 Jun 14; 134(22):224107. PubMed ID: 21682507
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  • 16. A multiscale coarse-graining method for biomolecular systems.
    Izvekov S, Voth GA.
    J Phys Chem B; 2005 Feb 24; 109(7):2469-73. PubMed ID: 16851243
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  • 17. Peptide folding using multiscale coarse-grained models.
    Thorpe IF, Zhou J, Voth GA.
    J Phys Chem B; 2008 Oct 16; 112(41):13079-90. PubMed ID: 18808094
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  • 20. A molecular dynamics simulation study of buckyballs in water: atomistic versus coarse-grained models of C60.
    Choudhury N.
    J Chem Phys; 2006 Jul 21; 125(3):34502. PubMed ID: 16863357
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