This is an application for configuring and running simulations with OpenMM. It provides a graphical interface for selecting input files, cleaning up PDB structures, and setting simulation options. It can then either save a script for running the simulation later, or directly run the simulation itself.
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openmm_setup-1.7.tar.gz
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- Download URL: openmm_setup-1.7.tar.gz
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twine/6.2.0 CPython/3.12.12
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