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ESPResSo is a highly versatile software package for scientific simulations and analysis of coarse-grained atomistic or bead-spring models as they are used in soft matter research, with emphasis on charged systems.
The Parallel Method Invocation (PMI) module allows to call arbitrary Python functions in parallel, and to create parallel instances of objects and call methods thereof. MPI can be used within the functions.
Plugin for the VMD molecular viewer that handles periodic boundary conditions.
ScaFaCoS is a library for Parallel Fast Coulomb Solvers.
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