RMG-database v3.0.0 Release

ReactionMechanismGenerator · Dec 17, 2019 · f969a74 · f969a74
2 parents 08b8214 + 0674fc9
commit f969a74
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Showing 58 changed files with 12,688 additions and 3,564 deletions.
diff --git a/.conda/conda_build_config.yaml b/.conda/conda_build_config.yaml
@@ -0,0 +1,5 @@
+python:
+  - 3.7
+numpy:
+  - 1.15
+
diff --git a/.travis.yml b/.travis.yml
@@ -11,7 +11,7 @@ env:
 stages:
   - test
   - name: deploy
-    if: branch = stable
+    if: branch = stable AND type = push
 
 before_install:
   - cd ..
@@ -34,9 +34,11 @@ jobs:
         # This is the RMG-database project, so need to fetch RMG-Py
         - git clone https://github.com/ReactionMechanismGenerator/RMG-Py.git
         - cd RMG-Py
-        - conda env create -q -f environment_linux.yml
+        - conda env create -q -f environment.yml
         - source activate rmg_env
         - conda list
+        # Install Q2DTor
+        - git clone -b arkanepy3 https://github.com/mjohnson541/Q2DTor.git external/Q2DTor
         - make
       script:
         - make test-unittests

diff --git a/families/images/2+2_cycloaddition_Cd.png b/families/images/2+2_cycloaddition_Cd.png
diff --git a/families/rmg_reaction_families.pdf b/families/rmg_reaction_families.pdf
-Original file line number
+Diff line change
@@ -0,0 +1,5 @@
+    python:
+      - 3.7
+    numpy:
+      - 1.15