Merge pull request #497 from choderalab/update-conda

Update meta.yaml
choderalab · Jan 14, 2019 · bc355fb · bc355fb
2 parents 8f52e83 + a0ca117
commit bc355fb
Showing 1 changed file with 4 additions and 8 deletions.
diff --git a/devtools/conda-recipe/meta.yaml b/devtools/conda-recipe/meta.yaml
@@ -18,21 +18,19 @@ requirements:
     - numexpr
     - autograd
     - pymbar
-    - cuda92
     - openmm >=7.3.0
-    - parmed
     - openmoltools
     - openmmtools
     - numba
     - netcdf4
     - matplotlib
     - seaborn
     - mdtraj
-    - parmed # for testing/debugging
-    #- pdbfixer
+    - pdbfixer
     - lxml
     - networkx >=2.0
     - yank
+    - parmed
 
   run:
     - python
@@ -42,7 +40,6 @@ requirements:
     - numexpr
     - autograd
     - pymbar
-    - cuda92
     - openmm >=7.3.0
     - parmed
     - openmoltools
@@ -52,16 +49,15 @@ requirements:
     - matplotlib
     - seaborn
     - mdtraj
-    - parmed # for testing/debugging
-    #- pdbfixer
+    - pdbfixer
     - lxml
     - networkx >=2.0
     - openeye-toolkits
     - dask
     - distributed
     - progressbar2
     - yank
-
+    - parmed
 test:
   requires:
     - nose