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Journal Articles

Relative stability of the open and closed conformations of the active site loop of streptavidin

Ignacio J. General, Hagai Meirovitch
Journal: The Journal of Chemical Physics
J. Chem. Phys. 134, 025104 (2011)
https://doi.org/10.1063/1.3521267
Published: January 2011
View article titled, Relative stability of the open and closed conformations of the active site loop of streptavidin
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Journal Articles

Calculation of the entropy and free energy of peptides by molecular dynamics simulations using the hypothetical scanning molecular dynamics method

Srinath Cheluvaraja, Hagai Meirovitch
Journal: The Journal of Chemical Physics
J. Chem. Phys. 125, 024905 (2006)
https://doi.org/10.1063/1.2208608
Published: July 2006
View article titled, Calculation of the entropy and free energy of peptides by molecular dynamics simulations using the hypothetical scanning molecular dynamics method
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Journal Articles

Free volume hypothetical scanning molecular dynamics method for the absolute free energy of liquids

Ronald P. White, Hagai Meirovitch
Journal: The Journal of Chemical Physics
J. Chem. Phys. 124, 204108 (2006)
https://doi.org/10.1063/1.2199529
Published: May 2006
View article titled, Free volume hypothetical scanning molecular dynamics method for the absolute free energy of liquids
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Journal Articles

Calculation of the entropy of random coil polymers with the hypothetical scanning Monte Carlo method

Ronald P. White, Hagai Meirovitch
Journal: The Journal of Chemical Physics
J. Chem. Phys. 123, 214908 (2005)
https://doi.org/10.1063/1.2132285
Published: December 2005
View article titled, Calculation of the entropy of random coil polymers with the hypothetical scanning Monte Carlo method
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Journal Articles

Calculation of the entropy and free energy by the hypothetical scanning Monte Carlo method: Application to peptides

Srinath Cheluvaraja, Hagai Meirovitch
Journal: The Journal of Chemical Physics
J. Chem. Phys. 122, 054903 (2005)
https://doi.org/10.1063/1.1835911
Published: January 2005
View article titled, Calculation of the entropy and free energy by the hypothetical scanning Monte Carlo method: Application to peptides
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Journal Articles

Lower and upper bounds for the absolute free energy by the hypothetical scanning Monte Carlo method: Application to liquid argon and water

Ronald P. White, Hagai Meirovitch
Journal: The Journal of Chemical Physics
J. Chem. Phys. 121, 10889–10904 (2004)
https://doi.org/10.1063/1.1814355
Published: December 2004
View article titled, Lower and upper bounds for the absolute free energy by the hypothetical scanning Monte Carlo method: Application to liquid argon and water
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Journal Articles

Absolute entropy and free energy of fluids using the hypothetical scanning method. I. Calculation of transition probabilities from local grand canonical partition functions

Agnieszka Szarecka, Ronald P. White, Hagai Meirovitch
Journal: The Journal of Chemical Physics
J. Chem. Phys. 119, 12084–12095 (2003)
https://doi.org/10.1063/1.1625919
Published: December 2003
View article titled, Absolute entropy and free energy of fluids using the hypothetical scanning method. I. Calculation of transition probabilities from local grand canonical partition functions
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Journal Articles

Absolute entropy and free energy of fluids using the hypothetical scanning method. II. Transition probabilities from canonical Monte Carlo simulations of partial systems

Ronald P. White, Hagai Meirovitch
Journal: The Journal of Chemical Physics
J. Chem. Phys. 119, 12096–12105 (2003)
https://doi.org/10.1063/1.1625920
Published: December 2003
View article titled, Absolute entropy and free energy of fluids using the hypothetical scanning method. II. Transition probabilities from canonical Monte Carlo simulations of partial systems
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Journal Articles

On the simulation of the entropy of macromolecules with different flexibilities

Hagai Meirovitch
Journal: The Journal of Chemical Physics
J. Chem. Phys. 114, 3859–3867 (2001)
https://doi.org/10.1063/1.1344614
Published: March 2001
View article titled, On the simulation of the entropy of macromolecules with different flexibilities
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Journal Articles

Simulation of a free energy upper bound, based on the anticorrelation between an approximate free energy functional and its fluctuation

Hagai Meirovitch
Journal: The Journal of Chemical Physics
J. Chem. Phys. 111, 7215–7224 (1999)
https://doi.org/10.1063/1.480050
Published: October 1999
View article titled, Simulation of a free energy upper bound, based on the anticorrelation between an approximate free energy functional and its fluctuation
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Journal Articles

New conformational search method based on local torsional deformations for cyclic molecules, loops in proteins, and dense polymer systems

Canan Baysal, Hagai Meirovitch
Journal: The Journal of Chemical Physics
J. Chem. Phys. 105, 7868–7871 (1996)
https://doi.org/10.1063/1.472607
Published: November 1996
View article titled, New conformational search method based on local torsional deformations for cyclic molecules, loops in proteins, and dense polymer systems
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Journal Articles

Entropy, pressure, and chemical potential of multiple chain systems from computer simulation. I. Application of the scanning method

Hagai Meirovitch
Journal: The Journal of Chemical Physics
J. Chem. Phys. 97, 5803–5815 (1992)
https://doi.org/10.1063/1.463739
Published: October 1992
View article titled, Entropy, pressure, and chemical potential of multiple chain systems from computer simulation. I. Application of the scanning method
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Journal Articles

Entropy, pressure, and chemical potential of multiple chain systems from computer simulation. II. Application of the Metropolis and the hypothetical scanning methods

Hagai Meirovitch
Journal: The Journal of Chemical Physics
J. Chem. Phys. 97, 5816–5823 (1992)
https://doi.org/10.1063/1.463740
Published: October 1992
View article titled, Entropy, pressure, and chemical potential of multiple chain systems from computer simulation. II. Application of the Metropolis and the hypothetical scanning methods
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Journal Articles

Computer simulation study of the θ‐point in three dimensions. I. Self‐avoiding walks on a simple cubic lattice

Hagai Meirovitch, H. A. Lim
Journal: The Journal of Chemical Physics
J. Chem. Phys. 92, 5144–5154 (1990)
https://doi.org/10.1063/1.458548
Published: April 1990
View article titled, Computer simulation study of the θ‐point in three dimensions. I. Self‐avoiding walks on a simple cubic lattice
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Journal Articles

Computer simulation study of the θ‐point in three dimensions. II. Trails on a simple cubic lattice

Hagai Meirovitch, H. A. Lim
Journal: The Journal of Chemical Physics
J. Chem. Phys. 92, 5155–5161 (1990)
https://doi.org/10.1063/1.458549
Published: April 1990
View article titled, Computer simulation study of the θ‐point in three dimensions. II. Trails on a simple cubic lattice
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Journal Articles

Free energy and stability of macromolecules studied by the double scanning simulation procedure

Hagai Meirovitch, M. Vásquez, Harold A. Scheraga
Journal: The Journal of Chemical Physics
J. Chem. Phys. 92, 1248–1257 (1990)
https://doi.org/10.1063/1.458134
Published: January 1990
View article titled, Free energy and stability of macromolecules studied by the double scanning simulation procedure
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Journal Articles

Statistical properties of the scanning simulation method for polymer chains

Hagai Meirovitch
Journal: The Journal of Chemical Physics
J. Chem. Phys. 89, 2514–2522 (1988)
https://doi.org/10.1063/1.455045
Published: August 1988
View article titled, Statistical properties of the scanning simulation method for polymer chains
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Journal Articles

Computer simulation of long polymers adsorbed on a surface. I. Corrections to scaling in an ideal chain

Shelly Livne, Hagai Meirovitch
Journal: The Journal of Chemical Physics
J. Chem. Phys. 88, 4498–4506 (1988)
https://doi.org/10.1063/1.453809
Published: April 1988
View article titled, Computer simulation of long polymers adsorbed on a surface. I. Corrections to scaling in an ideal chain
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Journal Articles

Computer simulation of long polymers adsorbed on a surface. II. Critical behavior of a single self‐avoiding walk

Hagai Meirovitch, Shelly Livne
Journal: The Journal of Chemical Physics
J. Chem. Phys. 88, 4507–4515 (1988)
https://doi.org/10.1063/1.453758
Published: April 1988
View article titled, Computer simulation of long polymers adsorbed on a surface. II. Critical behavior of a single self‐avoiding walk
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Journal Articles

Computer simulation of the entropy of continuum chain models: The two‐dimensional freely jointed chain of hard disks

Hagai Meirovitch, Harold A. Scheraga
Journal: The Journal of Chemical Physics
J. Chem. Phys. 84, 6369–6375 (1986)
https://doi.org/10.1063/1.450729
Published: June 1986
View article titled, Computer simulation of the entropy of continuum chain models: The two‐dimensional freely jointed chain of hard disks
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