Metadata-Version: 2.4
Name: OpenMM-Setup
Version: 1.7
Summary: OpenMM Setup: User interface for preparing and running OpenMM simulations
Home-page: https://github.com/peastman/openmm-setup
Author: Peter Eastman
License: MIT
Platform: Linux
Platform: Mac OS-X
Platform: Unix
Platform: Windows
Classifier: Development Status :: 5 - Production/Stable
Classifier: Intended Audience :: Science/Research
Classifier: Intended Audience :: End Users/Desktop
Classifier: License :: OSI Approved :: MIT License
Classifier: Programming Language :: Python
Classifier: Programming Language :: Python :: 3
Classifier: Topic :: Scientific/Engineering :: Bio-Informatics
Classifier: Topic :: Scientific/Engineering :: Chemistry
Classifier: Topic :: Scientific/Engineering :: Physics
Classifier: Operating System :: Microsoft :: Windows
Classifier: Operating System :: POSIX
Classifier: Operating System :: Unix
Classifier: Operating System :: MacOS
License-File: LICENSE
Requires-Dist: flask
Requires-Dist: openmm>=8.4
Requires-Dist: pdbfixer>=1.5
Dynamic: author
Dynamic: classifier
Dynamic: description
Dynamic: home-page
Dynamic: license
Dynamic: license-file
Dynamic: platform
Dynamic: requires-dist
Dynamic: summary

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.
