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APBS

From UABgrid Documentation

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[http://www.poissonboltzmann.org/apbs APBS - Adaptive Poisson-Boltzmann Solver] ''APBS is a software package for the numerical solution of the Poisson-Boltzmann equation (PBE), one of the most popular continuum models for describing electrostatic interactions between molecular solutes in salty, aqueous media.''
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[http://www.poissonboltzmann.org/apbs APBS - Adaptive Poisson-Boltzmann Solver] is a software package for the numerical solution of the Poisson-Boltzmann equation (PBE), one of the most popular continuum models for describing electrostatic interactions between molecular solutes in salty, aqueous media.
  
 
'''Project website:''' http://www.poissonboltzmann.org/apbs
 
'''Project website:''' http://www.poissonboltzmann.org/apbs
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module load apbs/apbs-1.0  
 
module load apbs/apbs-1.0  
 
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[[Category:Software]]

Latest revision as of 07:43, 4 April 2012

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APBS - Adaptive Poisson-Boltzmann Solver is a software package for the numerical solution of the Poisson-Boltzmann equation (PBE), one of the most popular continuum models for describing electrostatic interactions between molecular solutes in salty, aqueous media.

Project website: http://www.poissonboltzmann.org/apbs

Submit APBS jobs via the Grid Engine and do not run them on the head node!

[edit] Load SGE module

module load apbs/apbs-1.0