(Q46645831)

English

Nonperiodic boundary conditions for solvated systems

scientific article published in July 2005

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scholarly article

1 reference

Europe PubMed Central

PubMed publication ID

23 December 2017

http://europepmc.org/abstract/MED/16095342

Nonperiodic boundary conditions for solvated systems (English)

1 reference

Europe PubMed Central

PubMed publication ID

23 December 2017

http://europepmc.org/abstract/MED/16095342

boundary condition

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Michele Parrinello

3

object named as

Michele Parrinello

1 reference

Europe PubMed Central

PubMed publication ID

23 December 2017

http://europepmc.org/abstract/MED/16095342

author name string

Gabriele Petraglio

1

1 reference

Europe PubMed Central

PubMed publication ID

23 December 2017

http://europepmc.org/abstract/MED/16095342

Matteo Ceccarelli

2

1 reference

Europe PubMed Central

PubMed publication ID

23 December 2017

http://europepmc.org/abstract/MED/16095342

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publication date

1 July 2005

1 reference

Europe PubMed Central

PubMed publication ID

23 December 2017

http://europepmc.org/abstract/MED/16095342

Journal of Chemical Physics

1 reference

Europe PubMed Central

PubMed publication ID

23 December 2017

http://europepmc.org/abstract/MED/16095342

123

1 reference

Europe PubMed Central

PubMed publication ID

23 December 2017

http://europepmc.org/abstract/MED/16095342

4

1 reference

Europe PubMed Central

PubMed publication ID

23 December 2017

http://europepmc.org/abstract/MED/16095342

044103

1 reference

Europe PubMed Central

PubMed publication ID

23 December 2017

http://europepmc.org/abstract/MED/16095342

Die Berechnung optischer und elektrostatischer Gitterpotentiale

1 reference

https://api.crossref.org/works/10.1063%2F1.1955449

21 January 2018

Effect of artificial periodicity in simulations of biomolecules under Ewald boundary conditions: a continuum electrostatics study

1 reference

https://api.crossref.org/works/10.1063%2F1.1955449

21 January 2018

Towards molecular dynamics simulation of large proteins with a hydration shell at constant pressure.

1 reference

https://api.crossref.org/works/10.1063%2F1.1955449

21 January 2018

A mean field approach for molecular simulations of fluid systems

1 reference

https://api.crossref.org/works/10.1063%2F1.1955449

21 January 2018

Biased probability Monte Carlo conformational searches and electrostatic calculations for peptides and proteins

1 reference

https://api.crossref.org/works/10.1063%2F1.1955449

21 January 2018

Reversible multiple time scale molecular dynamics

1 reference

https://api.crossref.org/works/10.1063%2F1.1955449

21 January 2018

Comparison of simple potential functions for simulating liquid water

1 reference

https://api.crossref.org/works/10.1063%2F1.1955449

21 January 2018

Numerical integration of the cartesian equations of motion of a system with constraints: molecular dynamics of n-alkanes

1 reference

https://api.crossref.org/works/10.1063%2F1.1955449

21 January 2018

Reaction coordinates of biomolecular isomerization

1 reference

https://api.crossref.org/works/10.1063%2F1.1955449

21 January 2018

Escaping free-energy minima

1 reference

https://api.crossref.org/works/10.1063%2F1.1955449

21 January 2018

Efficient exploration of reactive potential energy surfaces using Car-Parrinello molecular dynamics

1 reference

https://api.crossref.org/works/10.1063%2F1.1955449

21 January 2018

Microscopic Mechanism of Antibiotics Translocation through a Porin

1 reference

https://api.crossref.org/works/10.1063%2F1.1955449

21 January 2018

A Second Generation Force Field for the Simulation of Proteins, Nucleic Acids, and Organic Molecules

1 reference

https://api.crossref.org/works/10.1063%2F1.1955449

21 January 2018

Identifiers

10.1063/1.1955449

1 reference

Europe PubMed Central

PubMed publication ID

23 December 2017

http://europepmc.org/abstract/MED/16095342

PubMed publication ID

1 reference

Europe PubMed Central

PubMed publication ID

23 December 2017

http://europepmc.org/abstract/MED/16095342

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