GROMOS

GROMOS is the name of a force field for molecular dynamics simulation, and a related computer software package. Both are developed at the University… (More)
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2014
2014
An extension of the GROMOS 53A6GLYC force field for carbohydrates to encompass glycoprotein linkages is presented. The set… (More)
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2012
2012
Since the most recent description of the functionalities of the GROMOS software for biomolecular simulation in 2005 many new… (More)
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2010
2010
Molecular dynamics simulations are being applied to increasingly complex systems, including those involving small endogenous… (More)
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2009
2009
The GROMOS 53A6 parameter sets have been shown to reproduce an extensive range of thermodynamics data in condensed phase… (More)
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Review
2005
Review
2005
We present the latest version of the Groningen Molecular Simulation program package, GROMOS05. It has been developed for the… (More)
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2005
2005
Over the past decades, the GROMOS force field for biomolecular simulation has primarily been developed for performing molecular… (More)
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Highly Cited
2005
Highly Cited
2005
This article describes the software suite GROMACS (Groningen MAchine for Chemical Simulation) that was developed at the… (More)
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2005
2005
A new parameter set (referred to as 45A4) is developed for the explicit-solvent simulation of hexopyranose-based carbohydrates… (More)
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Highly Cited
2004
Highly Cited
2004
Successive parameterizations of the GROMOS force field have been used successfully to simulate biomolecular systems over a long… (More)
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Highly Cited
1995
Highly Cited
1995
A parallel message-passing implementation of a molecular dynamics (MD) program that is useful for bio(macro)molecules in aqueous… (More)
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