BIOMARKERS

Molecular Biopsy of Human Tumors

- a resource for Precision Medicine *

162 related articles for article (PubMed ID: 19791905)

  • 1. Quantum effects on the maximum in density of water as described by the TIP4PQ/2005 model.
    Noya EG; Vega C; Sesé LM; Ramírez R
    J Chem Phys; 2009 Sep; 131(12):124518. PubMed ID: 19791905
    [TBL] [Abstract][Full Text] [Related]  

  • 2. A study of the influence of isotopic substitution on the melting point and temperature of maximum density of water by means of path integral simulations of rigid models.
    McBride C; Aragones JL; Noya EG; Vega C
    Phys Chem Chem Phys; 2012 Nov; 14(43):15199-205. PubMed ID: 23042133
    [TBL] [Abstract][Full Text] [Related]  

  • 3. Can gas hydrate structures be described using classical simulations?
    Conde MM; Vega C; McBride C; Noya EG; Ramírez R; Sesé LM
    J Chem Phys; 2010 Mar; 132(11):114503. PubMed ID: 20331301
    [TBL] [Abstract][Full Text] [Related]  

  • 4. Quantum contributions in the ice phases: the path to a new empirical model for water-TIP4PQ/2005.
    McBride C; Vega C; Noya EG; Ramírez R; Sesé LM
    J Chem Phys; 2009 Jul; 131(2):024506. PubMed ID: 19604003
    [TBL] [Abstract][Full Text] [Related]  

  • 5. Competing quantum effects in the dynamics of a flexible water model.
    Habershon S; Markland TE; Manolopoulos DE
    J Chem Phys; 2009 Jul; 131(2):024501. PubMed ID: 19603998
    [TBL] [Abstract][Full Text] [Related]  

  • 6. Nuclear quantum effects in water clusters: the role of the molecular flexibility.
    González BS; Noya EG; Vega C; Sesé LM
    J Phys Chem B; 2010 Feb; 114(7):2484-92. PubMed ID: 20121175
    [TBL] [Abstract][Full Text] [Related]  

  • 7. Characterization of the TIP4P-Ew water model: vapor pressure and boiling point.
    Horn HW; Swope WC; Pitera JW
    J Chem Phys; 2005 Nov; 123(19):194504. PubMed ID: 16321097
    [TBL] [Abstract][Full Text] [Related]  

  • 8. Development of an improved four-site water model for biomolecular simulations: TIP4P-Ew.
    Horn HW; Swope WC; Pitera JW; Madura JD; Dick TJ; Hura GL; Head-Gordon T
    J Chem Phys; 2004 May; 120(20):9665-78. PubMed ID: 15267980
    [TBL] [Abstract][Full Text] [Related]  

  • 9. Vapor-liquid equilibria from the triple point up to the critical point for the new generation of TIP4P-like models: TIP4P/Ew, TIP4P/2005, and TIP4P/ice.
    Vega C; Abascal JL; Nezbeda I
    J Chem Phys; 2006 Jul; 125(3):34503. PubMed ID: 16863358
    [TBL] [Abstract][Full Text] [Related]  

  • 10. Classical and quantum gibbs free energies and phase behavior of water using simulation and cell theory.
    Klefas-Stennett M; Henchman RH
    J Phys Chem B; 2008 Aug; 112(32):9769-76. PubMed ID: 18637683
    [TBL] [Abstract][Full Text] [Related]  

  • 11. Heat capacity of water: A signature of nuclear quantum effects.
    Vega C; Conde MM; McBride C; Abascal JL; Noya EG; Ramirez R; Sesé LM
    J Chem Phys; 2010 Jan; 132(4):046101. PubMed ID: 20113070
    [TBL] [Abstract][Full Text] [Related]  

  • 12. Path integral calculation of free energies: quantum effects on the melting temperature of neon.
    Ramírez R; Herrero CP; Antonelli A; Hernández ER
    J Chem Phys; 2008 Aug; 129(6):064110. PubMed ID: 18715054
    [TBL] [Abstract][Full Text] [Related]  

  • 13. Isotope quantum effects in water around the freezing point.
    Hart RT; Mei Q; Benmore CJ; Neuefeind JC; Turner JF; Dolgos M; Tomberli B; Egelstaff PA
    J Chem Phys; 2006 Apr; 124(13):134505. PubMed ID: 16613459
    [TBL] [Abstract][Full Text] [Related]  

  • 14. Quantum path integral simulation of isotope effects in the melting temperature of ice Ih.
    Ramírez R; Herrero CP
    J Chem Phys; 2010 Oct; 133(14):144511. PubMed ID: 20950021
    [TBL] [Abstract][Full Text] [Related]  

  • 15. A reoptimization of the five-site water potential (TIP5P) for use with Ewald sums.
    Rick SW
    J Chem Phys; 2004 Apr; 120(13):6085-93. PubMed ID: 15267492
    [TBL] [Abstract][Full Text] [Related]  

  • 16. Critical comparison of classical and quantum mechanical treatments of the phase equilibria of water.
    Wick CD; Schenter GK
    J Chem Phys; 2006 Mar; 124(11):114505. PubMed ID: 16555899
    [TBL] [Abstract][Full Text] [Related]  

  • 17. On the structural and transport properties of the soft sticky dipole and related single-point water models.
    Fennell CJ; Gezelter JD
    J Chem Phys; 2004 May; 120(19):9175-84. PubMed ID: 15267854
    [TBL] [Abstract][Full Text] [Related]  

  • 18. Relation between the melting temperature and the temperature of maximum density for the most common models of water.
    Vega C; Abascal JL
    J Chem Phys; 2005 Oct; 123(14):144504. PubMed ID: 16238404
    [TBL] [Abstract][Full Text] [Related]  

  • 19. The phase diagram of water from quantum simulations.
    McBride C; Noya EG; Aragones JL; Conde MM; Vega C
    Phys Chem Chem Phys; 2012 Aug; 14(29):10140-6. PubMed ID: 22729111
    [TBL] [Abstract][Full Text] [Related]  

  • 20. Growing correlation length in supercooled water.
    Moore EB; Molinero V
    J Chem Phys; 2009 Jun; 130(24):244505. PubMed ID: 19566164
    [TBL] [Abstract][Full Text] [Related]  

    [Next]    [New Search]
    of 9.