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GromacsWrapper

GromacsWrapper is a python package that wraps system calls to Gromacs tools into thin classes. This allows for fairly seamless integration of the gromacs tools into python scripts.

homepage: https://gromacswrapper.readthedocs.org

version versionsuffix toolchain
0.8.0 -Python-3.7.2 fosscuda/2019a

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