Add protein folding function

v1.1.11

update stjames

Add delete data functionality

• New function to delete any sensitive information (calculations, molecules, data)
• Add initial smiles to workflow submit

Add protein

v1.1.9

Add protein

Remove cctk dependency

v1.1.8

Merge branch 'master' of https://github.com/rowansci/rowan-python-int…

Add nest asyncio to rowan_rdkit

This will allow rowan_rdkit function to be in run environments with an existing event loop (e.g. Jupyter notebook)

Add Pyproject Dependencies

to simplify pip install

Update underlying batch implementation

v1.1.5

merge

Add Charges Function

same as before, but with correct pyproject.toml

Add Charges Function

v1.1.3

add charges

Update rowan_rdkit function names

Merge pull request #8 from rowansci/rowan-rdkit

Rowan rdkit