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APBS

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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.

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

module load apbs/apbs-1.0