Skip to content
Open
Show file tree
Hide file tree
Changes from all commits
Commits
File filter

Filter by extension

Filter by extension

Conversations
Failed to load comments.
Loading
Jump to
Jump to file
Failed to load files.
Loading
Diff view
Diff view
5 changes: 2 additions & 3 deletions .travis.yml
Original file line number Diff line number Diff line change
Expand Up @@ -23,15 +23,14 @@ script:
# Use beta version for partial bond orders
- pip install --pre -i https://pypi.anaconda.org/openeye/label/beta/simple openeye-toolkits && python -c "import openeye; print(openeye.__version__)"
# Install openforcefield tools
# TODO if changes to openforcefield become less dynamic switch to conda install?
- pip install git+https://github.com/openforcefield/openforcefield.git
- conda install --yes -c omnia openforcefield=0.0.3
# Build the recipe
- conda build devtools/conda-recipe
# Install
- conda install --yes --use-local smarty
# Run tests
- conda install --yes nose nose-timer
- cd devtools && nosetests -vv --nocapture --with-timer $PACKAGENAME && cd ..
- cd devtools && nosetests -vv --nocapture --with-coverage --with-timer $PACKAGENAME && cd ..

env:
matrix:
Expand Down
1 change: 1 addition & 0 deletions README.md
Original file line number Diff line number Diff line change
@@ -1,4 +1,5 @@
[![Build Status](https://travis-ci.org/openforcefield/smarty.svg?branch=master)](https://travis-ci.org/openforcefield/smarty?branch=master)
[![codecov](https://codecov.io/gh/openforcefield/smarty/branch/master/graph/badge.svg)](https://codecov.io/gh/openforcefield/smarty)
[![DOI](https://zenodo.org/badge/60921138.svg)](https://zenodo.org/badge/latestdoi/60921138)

# `smarty`: Exploring Bayesian atom type sampling
Expand Down