Merge pull request #9 from ecrl/dev

2.0.0
ecrl · Sep 9, 2022 · 9479814 · 9479814
2 parents 94361ee + 410ec99
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diff --git a/README.md b/README.md
@@ -1,6 +1,6 @@
 [![UML Energy & Combustion Research Laboratory](http://faculty.uml.edu/Hunter_Mack/uploads/9/7/1/3/97138798/1481826668_2.png)](http://faculty.uml.edu/Hunter_Mack/)
 
-# GraphChem: Graph-based machine learning for fuel property prediction
+# GraphChem: Graph-based machine learning for chemical property prediction
 
 [![GitHub version](https://badge.fury.io/gh/ecrl%2FGraphChem.svg)](https://badge.fury.io/gh/ecrl%2FGraphChem)
 [![PyPI version](https://badge.fury.io/py/graphchem.svg)](https://badge.fury.io/py/graphchem)

diff --git a/examples/model_cn.enc b/examples/model_cn.enc
diff --git a/examples/model_cn.pt b/examples/model_cn.pt
diff --git a/examples/model_mon.enc b/examples/model_mon.enc
diff --git a/examples/model_mon.pt b/examples/model_mon.pt
diff --git a/examples/model_ron.enc b/examples/model_ron.enc
diff --git a/examples/model_ron.pt b/examples/model_ron.pt
diff --git a/examples/predict_cn.ipynb b/examples/predict_cn.ipynb
diff --git a/examples/predict_mon.ipynb b/examples/predict_mon.ipynb
diff --git a/examples/predict_ron.ipynb b/examples/predict_ron.ipynb
diff --git a/examples/schweidtmann_test.csv b/examples/schweidtmann_test.csv