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sci-chemistry/gromacs
The ultimate molecular dynamics simulation package
dev-python/numexpr
Fast numerical array expression evaluator for Python and NumPy
sci-libs/armadillo
Streamlined C++ linear algebra library
sci-libs/dlib
Numerical and networking C++ library
sci-libs/trilinos
Scientific library collection for large scale problems
sci-libs/arrayfire
general purpose GPU library
sci-physics/SU2
SU2: An Open-Source Suite for Multiphysics Simulation and Design
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