Overview

AtomsMM is an OpenMM customization developed by the ATOMS group at UFRJ/Brazil.

• Free software: MIT license

Installation

git clone https://github.com/atoms-ufrj/atomsmm.git
cd atomsmm
python setup.py install

Documentation

https://atomsmm.readthedocs.io/

Development

To run the all tests run:

tox

Note, to combine the coverage data from all the tox environments run:

Windows	set PYTEST_ADDOPTS=--cov-append tox
Other	PYTEST_ADDOPTS=--cov-append tox