BIOMARKERS

Molecular Biopsy of Human Tumors

- a resource for Precision Medicine *

218 related articles for article (PubMed ID: 25194387)

  • 1. Adapting SAFT-γ perturbation theory to site-based molecular dynamics simulation. III. Molecules with partial charges at bulk phases, confined geometries and interfaces.
    Ghobadi AF; Elliott JR
    J Chem Phys; 2014 Sep; 141(9):094708. PubMed ID: 25194387
    [TBL] [Abstract][Full Text] [Related]  

  • 2. Adapting SAFT-γ perturbation theory to site-based molecular dynamics simulation. II. Confined fluids and vapor-liquid interfaces.
    Ghobadi AF; Elliott JR
    J Chem Phys; 2014 Jul; 141(2):024708. PubMed ID: 25028039
    [TBL] [Abstract][Full Text] [Related]  

  • 3. An accurate density functional theory for the vapor-liquid interface of associating chain molecules based on the statistical associating fluid theory for potentials of variable range.
    Gloor GJ; Jackson G; Blas FJ; Del Río EM; de Miguel E
    J Chem Phys; 2004 Dec; 121(24):12740-59. PubMed ID: 15606300
    [TBL] [Abstract][Full Text] [Related]  

  • 4. Adapting SAFT-γ perturbation theory to site-based molecular dynamics simulation. I. Homogeneous fluids.
    Ghobadi AF; Elliott JR
    J Chem Phys; 2013 Dec; 139(23):234104. PubMed ID: 24359349
    [TBL] [Abstract][Full Text] [Related]  

  • 5. Classical density functional theory for the prediction of the surface tension and interfacial properties of fluids mixtures of chain molecules based on the statistical associating fluid theory for potentials of variable range.
    Llovell F; Galindo A; Blas FJ; Jackson G
    J Chem Phys; 2010 Jul; 133(2):024704. PubMed ID: 20632767
    [TBL] [Abstract][Full Text] [Related]  

  • 6. A group contribution method for associating chain molecules based on the statistical associating fluid theory (SAFT-gamma).
    Lymperiadis A; Adjiman CS; Galindo A; Jackson G
    J Chem Phys; 2007 Dec; 127(23):234903. PubMed ID: 18154411
    [TBL] [Abstract][Full Text] [Related]  

  • 7. A density functional theory for vapor-liquid interfaces using the PCP-SAFT equation of state.
    Gross J
    J Chem Phys; 2009 Nov; 131(20):204705. PubMed ID: 19947702
    [TBL] [Abstract][Full Text] [Related]  

  • 8. Group contribution methodology based on the statistical associating fluid theory for heteronuclear molecules formed from Mie segments.
    Papaioannou V; Lafitte T; Avendaño C; Adjiman CS; Jackson G; Müller EA; Galindo A
    J Chem Phys; 2014 Feb; 140(5):054107. PubMed ID: 24511922
    [TBL] [Abstract][Full Text] [Related]  

  • 9. SAFT-γ force field for the simulation of molecular fluids: 2. Coarse-grained models of greenhouse gases, refrigerants, and long alkanes.
    Avendaño C; Lafitte T; Adjiman CS; Galindo A; Müller EA; Jackson G
    J Phys Chem B; 2013 Mar; 117(9):2717-33. PubMed ID: 23311931
    [TBL] [Abstract][Full Text] [Related]  

  • 10. An accurate density functional theory for the vapor-liquid interface of chain molecules based on the statistical associating fluid theory for potentials of variable range for Mie chainlike fluids.
    Algaba J; Míguez JM; Mendiboure B; Blas FJ
    Phys Chem Chem Phys; 2019 Jun; 21(22):11937-11948. PubMed ID: 31134241
    [TBL] [Abstract][Full Text] [Related]  

  • 11. A hybrid perturbed-chain SAFT density functional theory for representing fluid behavior in nanopores.
    Shen G; Ji X; Lu X
    J Chem Phys; 2013 Jun; 138(22):224706. PubMed ID: 23781814
    [TBL] [Abstract][Full Text] [Related]  

  • 12. Density functional theory for the prediction of interfacial properties of molecular fluids within the SAFT-γ coarse-grained approach.
    Algaba J; Mendiboure B; Gómez-Álvarez P; Blas FJ
    RSC Adv; 2022 Jun; 12(29):18821-18833. PubMed ID: 35873311
    [TBL] [Abstract][Full Text] [Related]  

  • 13. A global investigation of phase equilibria using the perturbed-chain statistical-associating-fluid-theory approach.
    Yelash L; Müller M; Paul W; Binder K
    J Chem Phys; 2005 Jul; 123(1):014908. PubMed ID: 16035870
    [TBL] [Abstract][Full Text] [Related]  

  • 14. SAFT-γ force field for the simulation of molecular fluids. 1. A single-site coarse grained model of carbon dioxide.
    Avendaño C; Lafitte T; Galindo A; Adjiman CS; Jackson G; Müller EA
    J Phys Chem B; 2011 Sep; 115(38):11154-69. PubMed ID: 21815624
    [TBL] [Abstract][Full Text] [Related]  

  • 15. Comparison of united-atom potentials for the simulation of vapor-liquid equilibria and interfacial properties of long-chain n-alkanes up to n-C100.
    Müller EA; Mejía A
    J Phys Chem B; 2011 Nov; 115(44):12822-34. PubMed ID: 21932822
    [TBL] [Abstract][Full Text] [Related]  

  • 16. Transport properties of mixtures by the soft-SAFT + free-volume theory: application to mixtures of n-alkanes and hydrofluorocarbons.
    Llovell F; Marcos RM; Vega LF
    J Phys Chem B; 2013 May; 117(17):5195-205. PubMed ID: 23566079
    [TBL] [Abstract][Full Text] [Related]  

  • 17. Thermodynamic properties of Lennard-Jones chain molecules: renormalization-group corrections to a modified statistical associating fluid theory.
    Llovell F; Pàmies JC; Vega LF
    J Chem Phys; 2004 Dec; 121(21):10715-24. PubMed ID: 15549957
    [TBL] [Abstract][Full Text] [Related]  

  • 18. On interfacial properties of tetrahydrofuran: Atomistic and coarse-grained models from molecular dynamics simulation.
    Garrido JM; Algaba J; Míguez JM; Mendiboure B; Moreno-Ventas Bravo AI; Piñeiro MM; Blas FJ
    J Chem Phys; 2016 Apr; 144(14):144702. PubMed ID: 27083740
    [TBL] [Abstract][Full Text] [Related]  

  • 19. Density functional theory for the description of spherical non-associating monomers in confined media using the SAFT-VR equation of state and weighted density approximations.
    Malheiro C; Mendiboure B; Plantier F; Blas FJ; Miqueu C
    J Chem Phys; 2014 Apr; 140(13):134707. PubMed ID: 24712808
    [TBL] [Abstract][Full Text] [Related]  

  • 20. Accurate statistical associating fluid theory for chain molecules formed from Mie segments.
    Lafitte T; Apostolakou A; Avendaño C; Galindo A; Adjiman CS; Müller EA; Jackson G
    J Chem Phys; 2013 Oct; 139(15):154504. PubMed ID: 24160524
    [TBL] [Abstract][Full Text] [Related]  

    [Next]    [New Search]
    of 11.