Add storing of norm of test error for neural nets
Add b3lyp datasets with nitrogens added
Update test_architectures so it will go faster
Add cam datasets with nitrogens added
Merge branch 'master' into new-data
Move data into a separate repo
Add data set as a submodule
Update the data loading function to use the new data format
Remove build_data.sh since it is in the data repo
Update neural.py to use the new load_data function
Update the README.md to include usage instructions
Add requirements.txt
Fix typos in requirements.txt
Add rdkit install requirements
Add ability to define the layers of the neural net via input arguments