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174 related items for PubMed ID: 26615943

  • 1. Molecular Dynamics in Physiological Solutions: Force Fields, Alkali Metal Ions, and Ionic Strength.
    Zhang C, Raugei S, Eisenberg B, Carloni P.
    J Chem Theory Comput; 2010 Jul 13; 6(7):2167-75. PubMed ID: 26615943
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  • 2. Ionic force field optimization based on single-ion and ion-pair solvation properties.
    Fyta M, Kalcher I, Dzubiella J, Vrbka L, Netz RR.
    J Chem Phys; 2010 Jan 14; 132(2):024911. PubMed ID: 20095713
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  • 3. Rational design of ion force fields based on thermodynamic solvation properties.
    Horinek D, Mamatkulov SI, Netz RR.
    J Chem Phys; 2009 Mar 28; 130(12):124507. PubMed ID: 19334851
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  • 4. Effect of NaCl and KCl on phosphatidylcholine and phosphatidylethanolamine lipid membranes: insight from atomic-scale simulations for understanding salt-induced effects in the plasma membrane.
    Gurtovenko AA, Vattulainen I.
    J Phys Chem B; 2008 Feb 21; 112(7):1953-62. PubMed ID: 18225878
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  • 6. Determination of alkali and halide monovalent ion parameters for use in explicitly solvated biomolecular simulations.
    Joung IS, Cheatham TE.
    J Phys Chem B; 2008 Jul 31; 112(30):9020-41. PubMed ID: 18593145
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  • 8. Temperature-dependent solubilities and mean ionic activity coefficients of alkali halides in water from molecular dynamics simulations.
    Mester Z, Panagiotopoulos AZ.
    J Chem Phys; 2015 Jul 28; 143(4):044505. PubMed ID: 26233143
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  • 9. Spontaneous Formation of KCl Aggregates in Biomolecular Simulations: A Force Field Issue?
    Auffinger P, Cheatham TE, Vaiana AC.
    J Chem Theory Comput; 2007 Sep 28; 3(5):1851-9. PubMed ID: 26627627
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  • 10. The short range anion-H interaction is the driving force for crystal formation of ions in water.
    Alejandre J, Chapela GA, Bresme F, Hansen JP.
    J Chem Phys; 2009 May 07; 130(17):174505. PubMed ID: 19425788
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  • 11. Effective interaction potentials for alkali and alkaline earth metal ions in SPC/E water and polarization model of hydrated ions.
    Gavryushov S.
    J Phys Chem B; 2006 Jun 08; 110(22):10888-95. PubMed ID: 16771341
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  • 12. Assessment of biomolecular force fields for molecular dynamics simulations in a protein crystal.
    Hu Z, Jiang J.
    J Comput Chem; 2010 Jan 30; 31(2):371-80. PubMed ID: 19479737
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  • 13. Force fields for divalent cations based on single-ion and ion-pair properties.
    Mamatkulov S, Fyta M, Netz RR.
    J Chem Phys; 2013 Jan 14; 138(2):024505. PubMed ID: 23320702
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  • 15. Molecular dynamics simulations of sodium dodecyl sulfate micelles in water-the effect of the force field.
    Tang X, Koenig PH, Larson RG.
    J Phys Chem B; 2014 Apr 10; 118(14):3864-80. PubMed ID: 24620851
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  • 20. Computation of methodology-independent single-ion solvation properties from molecular simulations. IV. Optimized Lennard-Jones interaction parameter sets for the alkali and halide ions in water.
    Reif MM, Hünenberger PH.
    J Chem Phys; 2011 Apr 14; 134(14):144104. PubMed ID: 21495739
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