diff --git a/README.md b/README.md index 28d33dd9fa6dc1fea8d97e6d2695daf51827572d..925bb4ef52ed9e61024c7ff073b30e98f7dcaea7 100644 --- a/README.md +++ b/README.md @@ -1,4 +1,5 @@ -[](https://travis-ci.org/jag1g13/pycgtool) [](http://pycgtool.readthedocs.io/en/master/?badge=master) +[](https://travis-ci.org/jag1g13/pycgtool) [](http://pycgtool.readthedocs.io/en/master/?badge=master) [](https://doi.org/10.5281/zenodo.259330) + # PyCGTOOL Please see http://pycgtool.readthedocs.io/en/master/ for full documentation. @@ -21,6 +22,8 @@ This version has several advantages over the original C++ implementation CGTOOL: If you experience problems or wish to see a new feature added please [file an issue](https://github.com/jag1g13/pycgtool/issues). +If you find this useful, please cite as : `Graham, J. (2017). PyCGTOOL, https://doi.org/10.5281/zenodo.259330` + ## Usage Input to PyCGTOOL is GROMACS GRO and XTC files, along with two custom files: MAP and BND. These files provide the atomistic-to-CG mapping and bonded topology respectively. Example files are present in the [test/data](https://github.com/jag1g13/pycgtool/tree/master/test/data) directory. The format of these files is described in the [full documentation] (http://pycgtool.readthedocs.io/en/master/).