(Q34765924)

4 August 2017

title

Enhancing protein adsorption simulations by using accelerated molecular dynamics (English)

1 reference

4 August 2017

Christian Mücksch

1

1 reference

4 August 2017

Herbert M Urbassek

series ordinal

2

1 reference

4 August 2017

language of work or name

English

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publication date

3 June 2013

1 reference

4 August 2017

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4 August 2017

volume

8

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4 August 2017

issue

6

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4 August 2017

page(s)

e64883

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Creative Commons Attribution 4.0 International

4 August 2017

copyright license

start time

3 June 2013

1 reference

April 2022 Public Data File from Crossref

copyright status

copyrighted

0 references

cites work

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7 July 2018

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Routine Access to Millisecond Time Scale Events with Accelerated Molecular Dynamics

7 July 2018

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Enhanced Lipid Diffusion and Mixing in Accelerated Molecular Dynamics

7 July 2018

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Lysozyme adsorption on polyethylene surfaces: why are long simulations needed?

7 July 2018

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7 July 2018

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Equilibrium sampling in biomolecular simulations

7 July 2018

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Calculation of adsorption free energy for solute-surface interactions using biased replica-exchange molecular dynamics

7 July 2018

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Surgical management of elbow dislocation associated with non-reparable fractures of the radial head

7 July 2018

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Understanding adsorption-desorption dynamics of BMP-2 on hydroxyapatite (001) surface

7 July 2018

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7 July 2018

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7 July 2018

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7 July 2018

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7 July 2018

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7 July 2018

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Accelerated molecular dynamics: a promising and efficient simulation method for biomolecules

7 July 2018

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Osteointegration of hydroxyapatite-titanium implants coated with nonglycosylated recombinant human bone morphogenetic protein-2 (BMP-2) in aged sheep.

21 January 2018

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Molecular dynamics simulations of the adsorption of bone morphogenetic protein-2 on surfaces with medical relevance.

21 January 2018

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Comparison of simple potential functions for simulating liquid water

21 January 2018

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

21 January 2018

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A theoretical study on the interaction of aromatic amino acids with graphene and single walled carbon nanotube

21 January 2018

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Predicting slow structural transitions in macromolecular systems: Conformational flooding

21 January 2018

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21 January 2018

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On the adsorption of proteins on solid surfaces, a common but very complicated phenomenon.

21 January 2018

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Flooding inGROMACS: Accelerated barrier crossings in molecular dynamics

26 October 2018

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12 December 2020

Examining the limits of time reweighting and Kramers' rate theory to obtain correct kinetics from accelerated molecular dynamics

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12 December 2020

Accelerated molecular dynamics in computational drug design

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12 December 2020

Accelerated and improved osteointegration of implants biocoated with bone morphogenetic protein 2 (BMP-2)

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12 December 2020

Protein adsorption on a hydrophobic surface: a molecular dynamics study of lysozyme on graphite

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12 December 2020

Comparison of solvation-effect methods for the simulation of peptide interactions with a hydrophobic surface

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12 December 2020

10.1371/JOURNAL.PONE.0064883

Identifiers

DOI

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4 August 2017

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1 reference

4 August 2017

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