Free energy of cavity formation in solvent: Computational, methodological, and physical aspects
- 1 March 1995
- journal article
- research article
- Published by AIP Publishing in The Journal of Chemical Physics
- Vol. 102 (9) , 3787-3793
- https://doi.org/10.1063/1.468560
Abstract
No abstract availableKeywords
This publication has 20 references indexed in Scilit:
- Free energy of solvation of a small Lennard–Jones particleJournal of Computational Chemistry, 1994
- Convergence of the Chemical Potential in Aqueous simulationsMolecular Simulation, 1991
- Free energy difference calculations by thermodynamic integration: Difficulties in obtaining a precise valueJournal of Computational Chemistry, 1991
- Cavities in molecular liquids and the theory of hydrophobic solubilitiesJournal of the American Chemical Society, 1990
- Molecular dynamics with coupling to an external bathThe Journal of Chemical Physics, 1984
- Thermodynamics of cavity formation in water. A molecular dynamics studyFaraday Symposia of the Chemical Society, 1982
- Ensemble Dependence of Fluctuations with Application to Machine ComputationsPhysical Review B, 1967
- Scaled Particle Methods in the Statistical Thermodynamics of FluidsAdvances in Chemical Physics, 1965
- Some Topics in the Theory of FluidsThe Journal of Chemical Physics, 1963
- High-Temperature Equation of State by a Perturbation Method. I. Nonpolar GasesThe Journal of Chemical Physics, 1954