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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.

Project website:

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

module load apbs/apbs-1.0