sort the deps, remove whitespace, remove double cython entry
name: test
channels:
- conda-forge
- - omnia
- defaults
+ - omnia
dependencies:
# Base depends
- - python
- - pip
-
- - setuptools
- - openmm >=7.5.0
- cython
- - python
- - numpy
- - scipy
- - parmed
+ - libnetcdf >=4.6.2 # workaround for libssl issues
- mdtraj
+ - mpiplus
- netcdf4 >=1.4.2 # after bugfix: "always return masked array by default, even if there are no masked values"
- - libnetcdf >=4.6.2 # workaround for libssl issues
+ - numba
+ - numpy
+ - openmm >=7.5.0
+ - parmed
+ - pip
+ - pymbar
+ - python
+ - python
- pyyaml
- - cython
+ - scipy
+ - setuptools
- sphinxcontrib-bibtex
- - mpiplus
- - pymbar
- - numba
-
# Testing
+ - codecov
- nose
- nose-timer
- pytest
- pytest-cov
- - codecov
-
- # Pip-only installs
- - pip:
- #- codecov
