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 *

675 related articles for article (PubMed ID: 23320702)

  • 1. Force fields for divalent cations based on single-ion and ion-pair properties.
    Mamatkulov S; Fyta M; Netz RR
    J Chem Phys; 2013 Jan; 138(2):024505. PubMed ID: 23320702
    [TBL] [Abstract][Full Text] [Related]  

  • 2. Ionic force field optimization based on single-ion and ion-pair solvation properties: going beyond standard mixing rules.
    Fyta M; Netz RR
    J Chem Phys; 2012 Mar; 136(12):124103. PubMed ID: 22462831
    [TBL] [Abstract][Full Text] [Related]  

  • 3. Rational design of ion force fields based on thermodynamic solvation properties.
    Horinek D; Mamatkulov SI; Netz RR
    J Chem Phys; 2009 Mar; 130(12):124507. PubMed ID: 19334851
    [TBL] [Abstract][Full Text] [Related]  

  • 4. 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; 132(2):024911. PubMed ID: 20095713
    [TBL] [Abstract][Full Text] [Related]  

  • 5. Kirkwood-Buff derived force field for alkali chlorides in simple point charge water.
    Klasczyk B; Knecht V
    J Chem Phys; 2010 Jan; 132(2):024109. PubMed ID: 20095665
    [TBL] [Abstract][Full Text] [Related]  

  • 6. A Kirkwood-Buff derived force field for alkaline earth halide salts.
    Naleem N; Bentenitis N; Smith PE
    J Chem Phys; 2018 Jun; 148(22):222828. PubMed ID: 29907021
    [TBL] [Abstract][Full Text] [Related]  

  • 7. 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; 134(14):144104. PubMed ID: 21495739
    [TBL] [Abstract][Full Text] [Related]  

  • 8. Force fields for monovalent and divalent metal cations in TIP3P water based on thermodynamic and kinetic properties.
    Mamatkulov S; Schwierz N
    J Chem Phys; 2018 Feb; 148(7):074504. PubMed ID: 29471634
    [TBL] [Abstract][Full Text] [Related]  

  • 9. Ion solvation thermodynamics from simulation with a polarizable force field.
    Grossfield A; Ren P; Ponder JW
    J Am Chem Soc; 2003 Dec; 125(50):15671-82. PubMed ID: 14664617
    [TBL] [Abstract][Full Text] [Related]  

  • 10. Hydration properties of magnesium and calcium ions from constrained first principles molecular dynamics.
    Ikeda T; Boero M; Terakura K
    J Chem Phys; 2007 Aug; 127(7):074503. PubMed ID: 17718616
    [TBL] [Abstract][Full Text] [Related]  

  • 11. Molecular dispersion energy parameters for alkali and halide ions in aqueous solution.
    Reiser S; Deublein S; Vrabec J; Hasse H
    J Chem Phys; 2014 Jan; 140(4):044504. PubMed ID: 25669552
    [TBL] [Abstract][Full Text] [Related]  

  • 12. Effect of cation size and charge on the interaction between silica surfaces in 1:1, 2:1, and 3:1 aqueous electrolytes.
    Dishon M; Zohar O; Sivan U
    Langmuir; 2011 Nov; 27(21):12977-84. PubMed ID: 21877732
    [TBL] [Abstract][Full Text] [Related]  

  • 13. Ion solvation in water from molecular dynamics simulation with the ABEEM/MM force field.
    Yang ZZ; Li X
    J Phys Chem A; 2005 Apr; 109(16):3517-20. PubMed ID: 16839014
    [TBL] [Abstract][Full Text] [Related]  

  • 14. 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; 112(30):9020-41. PubMed ID: 18593145
    [TBL] [Abstract][Full Text] [Related]  

  • 15. Hydration free energies of monovalent ions in transferable intermolecular potential four point fluctuating charge water: an assessment of simulation methodology and force field performance and transferability.
    Warren GL; Patel S
    J Chem Phys; 2007 Aug; 127(6):064509. PubMed ID: 17705614
    [TBL] [Abstract][Full Text] [Related]  

  • 16. Towards accurate solvation dynamics of divalent cations in water using the polarizable amoeba force field: From energetics to structure.
    Piquemal JP; Perera L; Cisneros GA; Ren P; Pedersen LG; Darden TA
    J Chem Phys; 2006 Aug; 125(5):054511. PubMed ID: 16942230
    [TBL] [Abstract][Full Text] [Related]  

  • 17. Molecular simulations of carbon dioxide and water: cation solvation.
    Criscenti LJ; Cygan RT
    Environ Sci Technol; 2013 Jan; 47(1):87-94. PubMed ID: 22779448
    [TBL] [Abstract][Full Text] [Related]  

  • 18. Effective interaction potentials for alkali and alkaline earth metal ions in SPC/E water and prediction of mean ion activity coefficients.
    Gavryushov S; Linse P
    J Phys Chem B; 2006 Jun; 110(22):10878-87. PubMed ID: 16771340
    [TBL] [Abstract][Full Text] [Related]  

  • 19. Molecular determinant for specific Ca/Ba selectivity profiles of low and high threshold Ca2+ channels.
    Cens T; Rousset M; Kajava A; Charnet P
    J Gen Physiol; 2007 Oct; 130(4):415-25. PubMed ID: 17893194
    [TBL] [Abstract][Full Text] [Related]  

  • 20. Transferable Ion Force Fields in Water from a Simultaneous Optimization of Ion Solvation and Ion-Ion Interaction.
    Loche P; Steinbrunner P; Friedowitz S; Netz RR; Bonthuis DJ
    J Phys Chem B; 2021 Aug; 125(30):8581-8587. PubMed ID: 34292738
    [TBL] [Abstract][Full Text] [Related]  

    [Next]    [New Search]
    of 34.