(Q47206131)

11 January 2018

title

Optimization of expanded ensemble methods (English)

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author name string

Fernando A Escobedo

series ordinal

1

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Francisco J Martinez-Veracoechea

series ordinal

2

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language of work or name

English

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publication date

1 October 2008

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Journal of Chemical Physics

published in

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volume

129

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issue

15

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page(s)

154107

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Efficient, Multiple-Range Random Walk Algorithm to Calculate the Density of States

cites work

1 reference

On the use of transition matrix methods with extended ensembles.

21 January 2018

1 reference

Performance Limitations of Flat-Histogram Methods

21 January 2018

1 reference

Optimizing the ensemble for equilibration in broad-histogram Monte Carlo simulations.

21 January 2018

1 reference

Overcoming the slowing down of flat-histogram Monte Carlo simulations: cluster updates and optimized broad-histogram ensembles.

21 January 2018

1 reference

Generalized ensemble and tempering simulations: a unified view.

21 January 2018

1 reference

Variance minimization of free energy estimates from optimized expanded ensembles

21 January 2018

1 reference

Optimized expanded ensembles for simulations involving molecular insertions and deletions. I. Closed systems.

21 January 2018

1 reference

On the use of Bennett's acceptance ratio method in multi-canonical-type simulations.

21 January 2018

1 reference

Comparison of free energy methods for molecular systems

21 January 2018

1 reference

Comparison of efficiency and bias of free energies computed by exponential averaging, the Bennett acceptance ratio, and thermodynamic integration

21 January 2018

1 reference

A Simplex Method for Function Minimization

21 January 2018

1 reference

Liquid crystalline behavior of a semifluorinated oligomer

21 January 2018

1 reference

Optimized expanded ensembles for simulations involving molecular insertions and deletions. II. Open systems.

21 January 2018

1 reference

Replica-exchange simulated tempering method for simulations of frustrated systems

21 January 2018

1 reference

21 January 2018

Identifiers

DOI

10.1063/1.2994717

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11 January 2018